#------------------------------------------------------------------------------
#$Date: 2016-03-23 16:49:15 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179395 $
#$URL: svn://www.crystallography.net/cod/cif/4/32/92/4329229.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_4329229
loop_
_publ_author_name
'Shigehisa Akine'
'Hiroki Nagumo'
'Tatsuya Nabeshima'
_publ_contact_author_address
;
Tsukuba, Ibaraki 305-8571, Japan
;
_publ_contact_author_email       akine@chem.tsukuba.ac.jp
_publ_contact_author_fax         +81-29-853-4527
_publ_contact_author_name        'Shigehisa Akine'
_publ_contact_author_phone       +81-29-853-4527
_publ_section_title
;
 Hierarchical Helix of Helix in the Crystal: Formation of Variable-Pitch
 Helical π-Stacked Array of Single-Helical Dinuclear Metal Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5506
_journal_page_last               5508
_journal_paper_doi               10.1021/ic3004273
_journal_volume                  51
_journal_year                    2012
_chemical_formula_moiety         C70.71H71N6.71O11.14Pd2
_chemical_formula_sum            'C70.71 H71 N6.71 O11.14 Pd2'
_chemical_formula_weight         1406.00
_chemical_name_common            '[LPd2]_19/7(Me2NCHO)_1/7(Et2O)_16/7(H2O)'
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 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                 94.4880(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            14
_cell_length_a                   18.3246(6)
_cell_length_b                   32.1089(10)
_cell_length_c                   39.6037(12)
_cell_measurement_reflns_used    225767
_cell_measurement_temperature    120
_cell_measurement_theta_max      27.50
_cell_measurement_theta_min      1.03
_cell_volume                     23230.7(13)
_computing_cell_refinement       'APEX2 (Bruker AXS, 2009)'
_computing_data_collection       'APEX2 (Bruker AXS, 2009)'
_computing_data_reduction        'APEX2 (Bruker AXS, 2009)'
_computing_molecular_graphics    ORTEP-3
_computing_publication_material  ORTEP-3
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXD (Sheldrick, 2000)'
_diffrn_ambient_temperature      120
_diffrn_detector_area_resol_mean 8.333
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Bruker APEXII CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  'multilayer confocal mirror'
_diffrn_radiation_source         'fine-focus rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0475
_diffrn_reflns_av_sigmaI/netI    0.0690
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       41
_diffrn_reflns_limit_k_min       -41
_diffrn_reflns_limit_l_max       51
_diffrn_reflns_limit_l_min       -51
_diffrn_reflns_number            225767
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.03
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.607
_exptl_absorpt_correction_T_max  0.9418
_exptl_absorpt_correction_T_min  0.8389
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.407
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             10128
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.301
_refine_diff_density_min         -1.784
_refine_diff_density_rms         0.124
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.064(16)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.091
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     5865
_refine_ls_number_reflns         102098
_refine_ls_number_restraints     1282
_refine_ls_restrained_S_all      1.094
_refine_ls_R_factor_all          0.0907
_refine_ls_R_factor_gt           0.0726
_refine_ls_shift/su_max          0.022
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0503P)²+111.4897P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1749
_refine_ls_wR_factor_ref         0.1867
_reflns_number_gt                85191
_reflns_number_total             102098
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic3004273_si_002.cif
_cod_data_source_block           nag351
_cod_database_code               4329229
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -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
Pd1 Pd 0.00358(3) 0.654651(19) 0.988629(14) 0.03545(13) Uani 1 1 d . . .
Pd2 Pd 0.10199(3) 0.723360(19) 0.923476(13) 0.02974(11) Uani 1 1 d . . .
C1 C 0.1069(4) 0.7163(3) 1.01458(19) 0.0418(13) Uani 1 1 d U . .
C2 C 0.1541(4) 0.6864(3) 1.0307(2) 0.0439(14) Uani 1 1 d U . .
C3 C 0.2250(4) 0.6997(4) 1.0432(2) 0.056(3) Uani 1 1 d . . .
H1 H 0.2580 0.6793 1.0527 0.067 Uiso 1 1 calc R . .
C4 C 0.2500(4) 0.7418(4) 1.0424(2) 0.064(3) Uani 1 1 d . . .
C5 C 0.2031(5) 0.7698(3) 1.0271(2) 0.050(2) Uani 1 1 d . . .
H2 H 0.2186 0.7979 1.0253 0.060 Uiso 1 1 calc R . .
C6 C 0.1326(4) 0.7589(3) 1.01393(17) 0.0361(12) Uani 1 1 d U . .
O1 O 0.0416(3) 0.71044(19) 0.99855(12) 0.0411(12) Uani 1 1 d U . .
C7 C 0.0855(5) 0.7918(3) 0.9990(2) 0.0433(19) Uani 1 1 d . . .
H3 H 0.0403 0.7835 0.9877 0.052 Uiso 1 1 calc R . .
O2 O 0.0989(4) 0.8290(2) 0.99977(18) 0.0638(18) Uani 1 1 d . . .
C8 C 0.3278(5) 0.7537(5) 1.0592(3) 0.081(4) Uani 1 1 d . . .
C9 C 0.3510(6) 0.7952(5) 1.0493(4) 0.099(5) Uani 1 1 d . . .
H4 H 0.3147 0.8158 1.0553 0.149 Uiso 1 1 calc R . .
H5 H 0.3555 0.7958 1.0248 0.149 Uiso 1 1 calc R . .
H6 H 0.3985 0.8018 1.0613 0.149 Uiso 1 1 calc R . .
C10 C 0.3214(6) 0.7518(5) 1.0988(3) 0.091(4) Uani 1 1 d . . .
H7 H 0.2854 0.7723 1.1052 0.137 Uiso 1 1 calc R . .
H8 H 0.3691 0.7579 1.1107 0.137 Uiso 1 1 calc R . .
H9 H 0.3055 0.7238 1.1051 0.137 Uiso 1 1 calc R . .
C11 C 0.3839(5) 0.7222(5) 1.0494(3) 0.086(4) Uani 1 1 d . . .
H10 H 0.3677 0.6941 1.0550 0.129 Uiso 1 1 calc R . .
H11 H 0.4312 0.7280 1.0619 0.129 Uiso 1 1 calc R . .
H12 H 0.3892 0.7240 1.0250 0.129 Uiso 1 1 calc R . .
N1 N 0.0781(4) 0.6255(2) 1.01907(16) 0.0462(18) Uani 1 1 d . . .
C12 C 0.1360(4) 0.6437(3) 1.03689(18) 0.047(2) Uani 1 1 d . . .
C13 C 0.1750(5) 0.6189(4) 1.0615(2) 0.059(3) Uani 1 1 d . . .
H13 H 0.2140 0.6307 1.0755 0.071 Uiso 1 1 calc R . .
C14 C 0.1567(6) 0.5769(4) 1.0653(3) 0.085(4) Uani 1 1 d . . .
H14 H 0.1853 0.5603 1.0811 0.102 Uiso 1 1 calc R . .
C15 C 0.0989(7) 0.5596(4) 1.0469(3) 0.071(3) Uani 1 1 d . . .
H15 H 0.0863 0.5311 1.0496 0.085 Uiso 1 1 calc R . .
C16 C 0.0591(5) 0.5849(3) 1.0241(2) 0.052(2) Uani 1 1 d . . .
N2 N -0.0337(4) 0.5976(2) 0.98145(17) 0.0473(18) Uani 1 1 d . . .
C17 C -0.0033(6) 0.5702(3) 1.0035(2) 0.058(3) Uani 1 1 d . . .
C18 C -0.0320(8) 0.5306(3) 1.0054(3) 0.085(4) Uani 1 1 d . . .
H16 H -0.0098 0.5107 1.0207 0.102 Uiso 1 1 calc R . .
C19 C -0.0958(9) 0.5204(4) 0.9839(3) 0.094(5) Uani 1 1 d . . .
H17 H -0.1177 0.4937 0.9856 0.112 Uiso 1 1 calc R . .
C20 C -0.1259(7) 0.5487(4) 0.9608(3) 0.080(4) Uani 1 1 d . . .
H18 H -0.1684 0.5420 0.9465 0.096 Uiso 1 1 calc R . .
C21 C -0.0915(5) 0.5884(3) 0.9588(2) 0.052(2) Uani 1 1 d . . .
C22 C -0.1354(4) 0.6867(3) 0.9064(2) 0.0450(15) Uani 1 1 d U . .
C23 C -0.1076(4) 0.6610(3) 0.9330(2) 0.0400(18) Uani 1 1 d . . .
C24 C -0.1173(4) 0.6168(3) 0.9310(2) 0.045(2) Uani 1 1 d . . .
C25 C -0.1474(5) 0.5997(4) 0.9010(2) 0.065(3) Uani 1 1 d . . .
H19 H -0.1505 0.5702 0.8989 0.078 Uiso 1 1 calc R . .
C26 C -0.1727(5) 0.6240(4) 0.8739(2) 0.068(3) Uani 1 1 d . . .
C27 C -0.1999(6) 0.6065(5) 0.8424(3) 0.091(4) Uani 1 1 d . . .
H20 H -0.2027 0.5770 0.8407 0.109 Uiso 1 1 calc R . .
C28 C -0.2211(6) 0.6286(5) 0.8158(3) 0.091(5) Uani 1 1 d . . .
H21 H -0.2387 0.6151 0.7954 0.109 Uiso 1 1 calc R . .
C29 C -0.2181(5) 0.6734(5) 0.8171(2) 0.085(5) Uani 1 1 d . . .
H22 H -0.2324 0.6897 0.7977 0.102 Uiso 1 1 calc R . .
C30 C -0.1936(4) 0.6919(4) 0.8475(2) 0.064(3) Uani 1 1 d . . .
H23 H -0.1934 0.7214 0.8492 0.077 Uiso 1 1 calc R . .
C31 C -0.1690(4) 0.6680(4) 0.8762(2) 0.055(3) Uani 1 1 d . . .
O3 O -0.0777(2) 0.68065(16) 0.96080(12) 0.0317(11) Uani 1 1 d . . .
C32 C -0.1230(4) 0.7315(3) 0.90917(18) 0.0424(12) Uani 1 1 d U . .
C33 C -0.0488(4) 0.7449(3) 0.90880(17) 0.0358(14) Uani 1 1 d U . .
C34 C -0.0339(4) 0.7893(3) 0.91268(18) 0.0397(18) Uani 1 1 d . . .
C35 C -0.0911(4) 0.8157(3) 0.91911(19) 0.044(2) Uani 1 1 d . . .
H24 H -0.0803 0.8442 0.9235 0.053 Uiso 1 1 calc R . .
C36 C -0.1641(4) 0.8025(3) 0.9195(2) 0.046(2) Uani 1 1 d . . .
C37 C -0.2204(5) 0.8298(4) 0.9259(2) 0.059(3) Uani 1 1 d . . .
H25 H -0.2098 0.8585 0.9300 0.071 Uiso 1 1 calc R . .
C38 C -0.2899(5) 0.8161(4) 0.9266(3) 0.075(3) Uani 1 1 d . . .
H26 H -0.3272 0.8348 0.9322 0.090 Uiso 1 1 calc R . .
C39 C -0.3074(5) 0.7743(4) 0.9191(3) 0.064(3) Uani 1 1 d . . .
H27 H -0.3568 0.7650 0.9182 0.077 Uiso 1 1 calc R . .
C40 C -0.2536(5) 0.7479(4) 0.9131(2) 0.061(3) Uani 1 1 d . . .
H28 H -0.2653 0.7195 0.9083 0.073 Uiso 1 1 calc R . .
C41 C -0.1800(4) 0.7607(3) 0.91361(19) 0.0463(15) Uani 1 1 d U . .
O4 O 0.0006(3) 0.7173(2) 0.90310(13) 0.0437(13) Uani 1 1 d . . .
N3 N 0.0994(3) 0.7846(2) 0.92093(14) 0.0317(13) Uani 1 1 d . . .
C42 C 0.0393(4) 0.8074(3) 0.9125(2) 0.0420(18) Uani 1 1 d . . .
C43 C 0.0499(5) 0.8485(3) 0.9028(3) 0.054(2) Uani 1 1 d . . .
H29 H 0.0088 0.8648 0.8948 0.065 Uiso 1 1 calc R . .
C44 C 0.1188(5) 0.8659(3) 0.9046(3) 0.062(3) Uani 1 1 d . . .
H30 H 0.1256 0.8938 0.8975 0.075 Uiso 1 1 calc R . .
C45 C 0.1785(5) 0.8420(3) 0.9170(3) 0.057(2) Uani 1 1 d . . .
H31 H 0.2255 0.8543 0.9206 0.069 Uiso 1 1 calc R . .
C46 C 0.1694(4) 0.8014(3) 0.9240(2) 0.0437(19) Uani 1 1 d . . .
N4 N 0.2047(3) 0.7325(2) 0.93943(15) 0.0337(14) Uani 1 1 d . . .
C47 C 0.2264(4) 0.7717(3) 0.93559(18) 0.0369(17) Uani 1 1 d . . .
C48 C 0.2995(5) 0.7835(3) 0.9417(2) 0.051(2) Uani 1 1 d . . .
H32 H 0.3137 0.8117 0.9394 0.061 Uiso 1 1 calc R . .
C49 C 0.3502(4) 0.7537(3) 0.9511(2) 0.048(2) Uani 1 1 d . . .
H33 H 0.4004 0.7611 0.9551 0.058 Uiso 1 1 calc R . .
C50 C 0.3285(4) 0.7130(3) 0.95471(18) 0.0404(18) Uani 1 1 d . . .
H34 H 0.3639 0.6921 0.9607 0.048 Uiso 1 1 calc R . .
C51 C 0.2540(4) 0.7022(3) 0.94962(18) 0.0382(18) Uani 1 1 d . . .
C52 C 0.1616(4) 0.6424(3) 0.94017(17) 0.0347(17) Uani 1 1 d . . .
C53 C 0.2308(3) 0.6582(2) 0.95373(18) 0.0336(16) Uani 1 1 d . . .
C54 C 0.2785(4) 0.6314(3) 0.9725(2) 0.051(2) Uani 1 1 d . . .
H35 H 0.3228 0.6428 0.9827 0.061 Uiso 1 1 calc R . .
C55 C 0.2655(5) 0.5895(3) 0.9773(3) 0.057(2) Uani 1 1 d . . .
C56 C 0.2015(5) 0.5728(3) 0.9625(2) 0.049(2) Uani 1 1 d . . .
H36 H 0.1925 0.5438 0.9644 0.059 Uiso 1 1 calc R . .
C57 C 0.1499(5) 0.5981(3) 0.9446(2) 0.046(2) Uani 1 1 d . . .
O5 O 0.1080(3) 0.6633(2) 0.92368(12) 0.0435(14) Uani 1 1 d . . .
C58 C 0.0836(5) 0.5797(3) 0.9309(2) 0.048(2) Uani 1 1 d . . .
H37 H 0.0474 0.5980 0.9209 0.058 Uiso 1 1 calc R . .
O6 O 0.0685(4) 0.5423(2) 0.93079(19) 0.0658(19) Uani 1 1 d D . .
C59 C 0.3262(6) 0.5624(4) 0.9960(3) 0.074(3) Uani 1 1 d . . .
C60 C 0.2992(9) 0.5198(5) 1.0023(5) 0.130(7) Uani 1 1 d . . .
H38 H 0.2821 0.5068 0.9807 0.195 Uiso 1 1 calc R . .
H39 H 0.2587 0.5213 1.0170 0.195 Uiso 1 1 calc R . .
H40 H 0.3390 0.5031 1.0134 0.195 Uiso 1 1 calc R . .
C61 C 0.3904(7) 0.5594(4) 0.9730(4) 0.093(4) Uani 1 1 d . . .
H41 H 0.3729 0.5473 0.9511 0.140 Uiso 1 1 calc R . .
H42 H 0.4290 0.5417 0.9838 0.140 Uiso 1 1 calc R . .
H43 H 0.4101 0.5873 0.9694 0.140 Uiso 1 1 calc R . .
C62 C 0.3534(7) 0.5825(5) 1.0297(4) 0.107(5) Uani 1 1 d . . .
H44 H 0.3124 0.5856 1.0439 0.161 Uiso 1 1 calc R . .
H45 H 0.3742 0.6099 1.0254 0.161 Uiso 1 1 calc R . .
H46 H 0.3911 0.5647 1.0412 0.161 Uiso 1 1 calc R . .
Pd3 Pd 0.17612(3) 0.71809(2) 0.851308(13) 0.03217(12) Uani 1 1 d . . .
Pd4 Pd 0.34968(3) 0.69841(2) 0.804816(15) 0.03700(14) Uani 1 1 d . . .
C63 C 0.2624(5) 0.6461(3) 0.87070(18) 0.0421(19) Uani 1 1 d . . .
C64 C 0.2057(5) 0.6175(2) 0.8612(2) 0.0424(19) Uani 1 1 d . . .
C65 C 0.2235(6) 0.5739(3) 0.8601(3) 0.061(3) Uani 1 1 d . . .
H47 H 0.1854 0.5554 0.8523 0.074 Uiso 1 1 calc R . .
C66 C 0.2904(6) 0.5568(3) 0.8692(2) 0.058(3) Uani 1 1 d . . .
C67 C 0.3451(6) 0.5852(3) 0.8792(2) 0.059(3) Uani 1 1 d . . .
H48 H 0.3929 0.5746 0.8847 0.070 Uiso 1 1 calc R . .
C68 C 0.3353(5) 0.6275(3) 0.8816(2) 0.047(2) Uani 1 1 d . . .
O7 O 0.2592(3) 0.68538(16) 0.87349(13) 0.0365(12) Uani 1 1 d . . .
C69 C 0.3946(4) 0.6545(3) 0.8927(2) 0.0433(18) Uani 1 1 d . . .
H49 H 0.3856 0.6836 0.8920 0.052 Uiso 1 1 calc R . .
O8 O 0.4551(4) 0.6431(2) 0.90277(18) 0.0623(18) Uani 1 1 d D . .
C70 C 0.3007(9) 0.5098(4) 0.8687(4) 0.094(4) Uani 1 1 d . . .
C71 C 0.3806(9) 0.4985(4) 0.8744(4) 0.106(5) Uani 1 1 d . . .
H50 H 0.4077 0.5113 0.8567 0.159 Uiso 1 1 calc R . .
H51 H 0.3860 0.4681 0.8735 0.159 Uiso 1 1 calc R . .
H52 H 0.4000 0.5087 0.8966 0.159 Uiso 1 1 calc R . .
C72 C 0.2562(9) 0.4914(4) 0.8973(4) 0.105(5) Uani 1 1 d . . .
H53 H 0.2751 0.5027 0.9192 0.157 Uiso 1 1 calc R . .
H54 H 0.2611 0.4610 0.8976 0.157 Uiso 1 1 calc R . .
H55 H 0.2045 0.4989 0.8930 0.157 Uiso 1 1 calc R . .
C73 C 0.2688(9) 0.4912(3) 0.8352(4) 0.098(5) Uani 1 1 d . . .
H56 H 0.2948 0.5026 0.8166 0.147 Uiso 1 1 calc R . .
H57 H 0.2168 0.4983 0.8317 0.147 Uiso 1 1 calc R . .
H58 H 0.2744 0.4609 0.8358 0.147 Uiso 1 1 calc R . .
N5 N 0.1096(3) 0.6704(2) 0.84420(16) 0.0401(16) Uani 1 1 d . . .
C74 C 0.1278(4) 0.6302(3) 0.85192(19) 0.0400(18) Uani 1 1 d . . .
C75 C 0.0719(6) 0.5995(3) 0.8524(2) 0.060(3) Uani 1 1 d . . .
H59 H 0.0829 0.5717 0.8592 0.071 Uiso 1 1 calc R . .
C76 C 0.0013(6) 0.6114(4) 0.8427(2) 0.062(3) Uani 1 1 d . . .
H60 H -0.0368 0.5913 0.8420 0.074 Uiso 1 1 calc R . .
C77 C -0.0150(5) 0.6517(4) 0.8339(2) 0.057(2) Uani 1 1 d . . .
H61 H -0.0637 0.6595 0.8265 0.069 Uiso 1 1 calc R . .
C78 C 0.0402(4) 0.6810(3) 0.83591(19) 0.0438(14) Uani 1 1 d U . .
N6 N 0.0902(3) 0.7477(2) 0.83138(15) 0.0407(12) Uani 1 1 d U . .
C79 C 0.0287(4) 0.7260(3) 0.82736(17) 0.0424(13) Uani 1 1 d U . .
C80 C -0.0377(5) 0.7421(3) 0.8183(2) 0.057(2) Uani 1 1 d U . .
H62 H -0.0798 0.7248 0.8155 0.069 Uiso 1 1 calc R . .
C81 C -0.0425(5) 0.7828(4) 0.8133(3) 0.074(3) Uani 1 1 d . . .
H63 H -0.0889 0.7949 0.8071 0.089 Uiso 1 1 calc R . .
C82 C 0.0196(5) 0.8084(4) 0.8172(3) 0.062(3) Uani 1 1 d . . .
H64 H 0.0156 0.8378 0.8144 0.074 Uiso 1 1 calc R . .
C83 C 0.0877(4) 0.7895(3) 0.8254(2) 0.0403(18) Uani 1 1 d . . .
C84 C 0.2876(4) 0.8279(3) 0.8380(2) 0.0385(17) Uani 1 1 d . . .
C85 C 0.2251(4) 0.8025(2) 0.84095(18) 0.0345(16) Uani 1 1 d . . .
C86 C 0.1556(4) 0.8152(3) 0.82456(18) 0.0381(17) Uani 1 1 d . . .
C87 C 0.1521(4) 0.8512(3) 0.8061(2) 0.0443(19) Uani 1 1 d . . .
H65 H 0.1069 0.8586 0.7942 0.053 Uiso 1 1 calc R . .
C88 C 0.2135(5) 0.8780(3) 0.8041(2) 0.048(2) Uani 1 1 d . . .
C89 C 0.2071(6) 0.9159(3) 0.7845(3) 0.060(3) Uani 1 1 d . . .
H66 H 0.1613 0.9236 0.7733 0.072 Uiso 1 1 calc R . .
C90 C 0.2667(6) 0.9407(3) 0.7820(3) 0.065(3) Uani 1 1 d . . .
H67 H 0.2624 0.9658 0.7692 0.079 Uiso 1 1 calc R . .
C91 C 0.3344(5) 0.9293(3) 0.7983(3) 0.055(2) Uani 1 1 d . . .
H68 H 0.3755 0.9470 0.7964 0.067 Uiso 1 1 calc R . .
C92 C 0.3429(5) 0.8932(3) 0.8169(2) 0.047(2) Uani 1 1 d . . .
H69 H 0.3893 0.8861 0.8277 0.057 Uiso 1 1 calc R . .
C93 C 0.2813(4) 0.8661(2) 0.8199(2) 0.0390(17) Uani 1 1 d . . .
O9 O 0.2355(2) 0.76861(16) 0.85957(12) 0.0321(11) Uani 1 1 d . . .
C94 C 0.3590(4) 0.8120(2) 0.85304(18) 0.0328(15) Uani 1 1 d . A .
C95 C 0.3867(4) 0.7752(3) 0.83947(19) 0.0376(17) Uani 1 1 d . . .
C96 C 0.4537(4) 0.7587(2) 0.85527(19) 0.0338(16) Uani 1 1 d . A .
C97 C 0.4861(4) 0.7760(3) 0.8838(2) 0.0434(19) Uani 1 1 d . . .
H70 H 0.5288 0.7634 0.8944 0.052 Uiso 1 1 calc R A .
C98 C 0.4587(4) 0.8119(3) 0.8980(2) 0.0393(18) Uani 1 1 d . A .
C99 C 0.4928(5) 0.8293(3) 0.9289(2) 0.051(2) Uani 1 1 d . . .
H71 H 0.5348 0.8163 0.9398 0.061 Uiso 1 1 calc R A .
C100 C 0.4647(5) 0.8648(3) 0.9427(2) 0.053(2) Uani 1 1 d . A .
H72 H 0.4875 0.8764 0.9629 0.064 Uiso 1 1 calc R . .
C101 C 0.4024(5) 0.8836(3) 0.9267(3) 0.058(3) Uani 1 1 d . . .
H73 H 0.3835 0.9081 0.9363 0.070 Uiso 1 1 calc R A .
C102 C 0.3671(4) 0.8675(2) 0.8969(2) 0.0439(19) Uani 1 1 d . A .
H74 H 0.3252 0.8812 0.8865 0.053 Uiso 1 1 calc R . .
C103 C 0.3938(4) 0.8307(2) 0.8820(2) 0.0366(17) Uani 1 1 d . . .
O10 O 0.3512(3) 0.75963(18) 0.81292(13) 0.0395(13) Uani 1 1 d . A .
N7 N 0.4499(3) 0.6918(2) 0.82492(16) 0.0358(14) Uani 1 1 d . A .
C104 C 0.4904(4) 0.7213(3) 0.8422(2) 0.0419(18) Uani 1 1 d . . .
C105 C 0.5655(4) 0.7151(3) 0.8479(2) 0.052(2) Uani 1 1 d . A .
H75 H 0.5951 0.7365 0.8585 0.063 Uiso 1 1 calc R . .
C106 C 0.5974(5) 0.6787(3) 0.8386(3) 0.063(3) Uani 1 1 d . . .
H76 H 0.6488 0.6748 0.8425 0.075 Uiso 1 1 calc R A .
C107 C 0.5538(5) 0.6476(3) 0.8235(2) 0.059(3) Uani 1 1 d . A .
H77 H 0.5746 0.6216 0.8178 0.071 Uiso 1 1 calc R . .
C108 C 0.4798(4) 0.6548(3) 0.8168(2) 0.0444(19) Uani 1 1 d . . .
N8 N 0.3572(4) 0.6384(2) 0.79458(15) 0.0483(18) Uani 1 1 d . A .
C109 C 0.4288(5) 0.6244(3) 0.8017(3) 0.057(2) Uani 1 1 d . A .
C110 C 0.4482(6) 0.5838(3) 0.7940(3) 0.069(3) Uani 1 1 d . . .
H78 H 0.4970 0.5743 0.7987 0.083 Uiso 1 1 calc R A .
C111 C 0.3947(6) 0.5576(4) 0.7793(3) 0.077(3) Uani 1 1 d . A .
H79 H 0.4061 0.5296 0.7741 0.092 Uiso 1 1 calc R . .
C112 C 0.3234(6) 0.5731(4) 0.7721(3) 0.072(3) Uani 1 1 d . . .
H80 H 0.2872 0.5559 0.7606 0.086 Uiso 1 1 calc R A .
C113 C 0.3048(5) 0.6136(3) 0.7817(2) 0.055(2) Uani 1 1 d . A .
C114 C 0.2097(5) 0.6715(4) 0.7737(2) 0.0538(17) Uani 1 1 d U . .
C115 C 0.2310(5) 0.6291(3) 0.7742(2) 0.050(2) Uani 1 1 d . A .
C116 C 0.1748(5) 0.5979(4) 0.7672(3) 0.073(3) Uani 1 1 d . . .
H81 H 0.1876 0.5693 0.7697 0.088 Uiso 1 1 calc R A .
C117 C 0.1013(5) 0.6084(4) 0.7567(3) 0.077(4) Uani 1 1 d . A .
C118 C 0.0831(5) 0.6489(4) 0.7549(2) 0.0674(17) Uani 1 1 d U . .
H82 H 0.0339 0.6562 0.7482 0.081 Uiso 1 1 calc R A .
C119 C 0.1348(5) 0.6813(4) 0.76256(19) 0.0557(14) Uani 1 1 d U A .
O11 O 0.2506(2) 0.7045(2) 0.78137(12) 0.0406(14) Uani 1 1 d . A .
C120 C 0.1144(5) 0.7250(4) 0.75745(19) 0.0608(14) Uani 1 1 d U . .
H83 H 0.1505 0.7458 0.7626 0.073 Uiso 1 1 calc R A .
O12 O 0.0524(4) 0.7363(3) 0.74679(17) 0.082(2) Uani 1 1 d U A .
C121 C 0.0493(7) 0.5710(6) 0.7464(3) 0.106(6) Uani 1 1 d . . .
C122 C -0.0312(6) 0.5876(5) 0.7485(4) 0.103(5) Uani 1 1 d . A .
H84 H -0.0363 0.5991 0.7711 0.154 Uiso 1 1 calc R . .
H85 H -0.0659 0.5645 0.7444 0.154 Uiso 1 1 calc R . .
H86 H -0.0416 0.6093 0.7314 0.154 Uiso 1 1 calc R . .
C123 C 0.0672(10) 0.5548(7) 0.7126(4) 0.188(10) Uani 1 1 d . A .
H87 H 0.0356 0.5309 0.7064 0.281 Uiso 1 1 calc R . .
H88 H 0.1185 0.5460 0.7139 0.281 Uiso 1 1 calc R . .
H89 H 0.0592 0.5768 0.6956 0.281 Uiso 1 1 calc R . .
C124 C 0.0583(7) 0.5335(5) 0.7723(5) 0.116(6) Uani 1 1 d . A .
H90 H 0.0465 0.5429 0.7948 0.174 Uiso 1 1 calc R . .
H91 H 0.1089 0.5233 0.7735 0.174 Uiso 1 1 calc R . .
H92 H 0.0250 0.5109 0.7647 0.174 Uiso 1 1 calc R . .
Pd5 Pd 0.41380(9) 0.71026(6) 0.73365(5) 0.0375(3) Uani 0.661(4) 1 d PDU A 1
C125 C 0.2813(5) 0.6713(4) 0.7036(3) 0.0397(11) Uani 0.661(4) 1 d PDU A 1
C126 C 0.2486(6) 0.7109(4) 0.6974(3) 0.0422(11) Uani 0.661(4) 1 d PDU A 1
C127 C 0.1796(6) 0.7110(6) 0.6771(3) 0.0546(15) Uani 0.661(4) 1 d PDU A 1
H93 H 0.1554 0.7368 0.6730 0.065 Uiso 0.661(4) 1 calc PR A 1
C128 C 0.1471(7) 0.6752(6) 0.6635(4) 0.0605(12) Uani 0.661(4) 1 d PDU A 1
C129 C 0.1784(6) 0.6395(5) 0.6695(3) 0.0513(15) Uani 0.661(4) 1 d PDU A 1
H94 H 0.1556 0.6148 0.6605 0.062 Uiso 0.661(4) 1 calc PR A 1
C130 C 0.2438(6) 0.6369(5) 0.6886(3) 0.0463(15) Uani 0.661(4) 1 d PDU A 1
O13 O 0.3462(4) 0.6641(3) 0.7193(2) 0.0386(12) Uani 0.661(4) 1 d PDU A 1
C131 C 0.2798(7) 0.5943(4) 0.6950(3) 0.0483(16) Uani 0.661(4) 1 d PDU A 1
H95 H 0.3276 0.5936 0.7062 0.058 Uiso 0.661(4) 1 calc PR A 1
O14 O 0.2512(6) 0.5616(4) 0.6867(3) 0.066(2) Uani 0.661(4) 1 d PDU A 1
C132 C 0.0704(7) 0.6822(6) 0.6421(3) 0.0748(10) Uani 0.661(4) 1 d PDU A 1
C133 C 0.0124(8) 0.6790(8) 0.6687(4) 0.0994(15) Uani 0.661(4) 1 d PDU A 1
H96 H 0.0212 0.6537 0.6823 0.149 Uiso 0.661(4) 1 calc PR A 1
H97 H -0.0367 0.6779 0.6570 0.149 Uiso 0.661(4) 1 calc PR A 1
H98 H 0.0163 0.7034 0.6836 0.149 Uiso 0.661(4) 1 calc PR A 1
C134 C 0.0563(8) 0.6483(7) 0.6196(4) 0.0844(15) Uani 0.661(4) 1 d PDU A 1
H99 H 0.0541 0.6224 0.6326 0.127 Uiso 0.661(4) 1 calc PR A 1
H100 H 0.0956 0.6463 0.6043 0.127 Uiso 0.661(4) 1 calc PR A 1
H101 H 0.0095 0.6527 0.6064 0.127 Uiso 0.661(4) 1 calc PR A 1
C135 C 0.0677(10) 0.7251(7) 0.6228(4) 0.094(2) Uani 0.661(4) 1 d PDU A 1
H102 H 0.0764 0.7478 0.6391 0.141 Uiso 0.661(4) 1 calc PR A 1
H103 H 0.0195 0.7286 0.6106 0.141 Uiso 0.661(4) 1 calc PR A 1
H104 H 0.1055 0.7255 0.6066 0.141 Uiso 0.661(4) 1 calc PR A 1
N9 N 0.3405(5) 0.7548(3) 0.7279(3) 0.0434(12) Uani 0.661(4) 1 d PDU A 1
C136 C 0.2731(6) 0.7494(4) 0.7140(4) 0.0475(14) Uani 0.661(4) 1 d PDU A 1
C137 C 0.2232(7) 0.7858(5) 0.7168(4) 0.0506(17) Uani 0.661(4) 1 d PDU A 1
H105 H 0.1737 0.7837 0.7078 0.061 Uiso 0.661(4) 1 calc PR A 1
C138 C 0.2457(7) 0.8210(5) 0.7314(3) 0.0494(17) Uani 0.661(4) 1 d PDU A 1
H106 H 0.2127 0.8436 0.7330 0.059 Uiso 0.661(4) 1 calc PR A 1
C139 C 0.3158(7) 0.8247(4) 0.7442(4) 0.0509(17) Uani 0.661(4) 1 d PDU A 1
H107 H 0.3327 0.8505 0.7536 0.061 Uiso 0.661(4) 1 calc PR A 1
C140 C 0.3632(6) 0.7913(4) 0.7436(3) 0.0438(14) Uani 0.661(4) 1 d PDU A 1
N10 N 0.4791(5) 0.7572(3) 0.7486(4) 0.0482(14) Uani 0.661(4) 1 d PDU A 1
C141 C 0.4375(6) 0.7922(4) 0.7559(3) 0.0440(13) Uani 0.661(4) 1 d PDU A 1
C142 C 0.4728(7) 0.8247(4) 0.7736(4) 0.0509(18) Uani 0.661(4) 1 d PDU A 1
H108 H 0.4472 0.8500 0.7766 0.061 Uiso 0.661(4) 1 calc PR A 1
C143 C 0.5456(8) 0.8211(5) 0.7869(4) 0.060(2) Uani 0.661(4) 1 d PDU A 1
H109 H 0.5679 0.8423 0.8008 0.073 Uiso 0.661(4) 1 calc PR A 1
C144 C 0.5839(7) 0.7858(4) 0.7793(4) 0.052(2) Uani 0.661(4) 1 d PDU A 1
H110 H 0.6329 0.7823 0.7885 0.062 Uiso 0.661(4) 1 calc PR A 1
C145 C 0.5500(6) 0.7543(4) 0.7575(4) 0.0420(18) Uani 0.661(4) 1 d PDU A 1
O15 O 0.4904(5) 0.6682(3) 0.7440(2) 0.0345(19) Uani 0.661(4) 1 d PDU A 1
Pd6 Pd 0.4217(2) 0.71649(14) 0.73039(11) 0.0375(3) Uani 0.339(4) 1 d PDU A 2
C146 C 0.2800(9) 0.6886(6) 0.6999(6) 0.0397(11) Uani 0.339(4) 1 d PDU A 2
C147 C 0.2492(9) 0.7288(6) 0.7006(6) 0.0422(11) Uani 0.339(4) 1 d PDU A 2
C148 C 0.1825(10) 0.7365(8) 0.6795(6) 0.0546(15) Uani 0.339(4) 1 d PDU A 2
H111 H 0.1646 0.7642 0.6767 0.065 Uiso 0.339(4) 1 calc PR A 2
C149 C 0.1442(10) 0.7038(8) 0.6631(6) 0.0605(12) Uani 0.339(4) 1 d PDU A 2
C150 C 0.1699(10) 0.6670(8) 0.6660(6) 0.0513(15) Uani 0.339(4) 1 d PDU A 2
H112 H 0.1418 0.6446 0.6562 0.062 Uiso 0.339(4) 1 calc PR A 2
C151 C 0.2367(10) 0.6583(7) 0.6829(6) 0.0463(15) Uani 0.339(4) 1 d PDU A 2
O16 O 0.3442(7) 0.6769(5) 0.7145(5) 0.0386(12) Uani 0.339(4) 1 d PDU A 2
C152 C 0.2581(13) 0.6123(7) 0.6891(7) 0.0483(16) Uani 0.339(4) 1 d PDU A 2
H113 H 0.2989 0.6060 0.7046 0.058 Uiso 0.339(4) 1 calc PR A 2
O17 O 0.2242(12) 0.5839(7) 0.6748(6) 0.066(2) Uani 0.339(4) 1 d PDU A 2
C153 C 0.0678(10) 0.7195(9) 0.6444(5) 0.0748(10) Uani 0.339(4) 1 d PDU A 2
C154 C 0.0108(13) 0.7028(12) 0.6676(7) 0.0994(15) Uani 0.339(4) 1 d PDU A 2
H114 H 0.0247 0.6747 0.6753 0.149 Uiso 0.339(4) 1 calc PR A 2
H115 H -0.0374 0.7020 0.6551 0.149 Uiso 0.339(4) 1 calc PR A 2
H116 H 0.0088 0.7211 0.6873 0.149 Uiso 0.339(4) 1 calc PR A 2
C155 C 0.0596(15) 0.6977(12) 0.6139(6) 0.0844(15) Uani 0.339(4) 1 d PDU A 2
H117 H 0.0454 0.6689 0.6182 0.127 Uiso 0.339(4) 1 calc PR A 2
H118 H 0.1060 0.6980 0.6031 0.127 Uiso 0.339(4) 1 calc PR A 2
H119 H 0.0215 0.7111 0.5988 0.127 Uiso 0.339(4) 1 calc PR A 2
C156 C 0.0654(19) 0.7688(9) 0.6417(8) 0.094(2) Uani 0.339(4) 1 d PDU A 2
H120 H 0.0761 0.7810 0.6642 0.141 Uiso 0.339(4) 1 calc PR A 2
H121 H 0.0166 0.7776 0.6325 0.141 Uiso 0.339(4) 1 calc PR A 2
H122 H 0.1020 0.7783 0.6266 0.141 Uiso 0.339(4) 1 calc PR A 2
N11 N 0.3550(7) 0.7649(5) 0.7304(6) 0.0434(12) Uani 0.339(4) 1 d PDU A 2
C157 C 0.2836(9) 0.7635(6) 0.7191(7) 0.0475(14) Uani 0.339(4) 1 d PDU A 2
C158 C 0.2392(11) 0.8021(7) 0.7223(8) 0.0506(17) Uani 0.339(4) 1 d PDU A 2
H123 H 0.1885 0.8030 0.7152 0.061 Uiso 0.339(4) 1 calc PR A 2
C159 C 0.2737(12) 0.8349(7) 0.7357(6) 0.0494(17) Uani 0.339(4) 1 d PDU A 2
H124 H 0.2489 0.8609 0.7351 0.059 Uiso 0.339(4) 1 calc PR A 2
C160 C 0.3429(12) 0.8331(7) 0.7502(7) 0.0509(17) Uani 0.339(4) 1 d PDU A 2
H125 H 0.3615 0.8558 0.7637 0.061 Uiso 0.339(4) 1 calc PR A 2
C161 C 0.3874(10) 0.7990(6) 0.7459(6) 0.0438(14) Uani 0.339(4) 1 d PDU A 2
N12 N 0.4927(8) 0.7565(5) 0.7536(8) 0.0482(14) Uani 0.339(4) 1 d PDU A 2
C162 C 0.4606(10) 0.7957(6) 0.7589(6) 0.0440(13) Uani 0.339(4) 1 d PDU A 2
C163 C 0.5011(12) 0.8228(7) 0.7803(7) 0.0509(18) Uani 0.339(4) 1 d PDU A 2
H126 H 0.4781 0.8471 0.7881 0.061 Uiso 0.339(4) 1 calc PR A 2
C164 C 0.5746(13) 0.8154(8) 0.7905(8) 0.060(2) Uani 0.339(4) 1 d PDU A 2
H127 H 0.6021 0.8347 0.8045 0.073 Uiso 0.339(4) 1 calc PR A 2
C165 C 0.6061(11) 0.7794(8) 0.7798(9) 0.052(2) Uani 0.339(4) 1 d PDU A 2
H128 H 0.6571 0.7748 0.7846 0.062 Uiso 0.339(4) 1 calc PR A 2
C166 C 0.5624(9) 0.7485(8) 0.7614(9) 0.0420(18) Uani 0.339(4) 1 d PDU A 2
O18 O 0.4918(9) 0.6701(5) 0.7347(6) 0.0345(19) Uani 0.339(4) 1 d PDU A 2
Pd7 Pd 0.41749(3) 0.65754(2) 0.646219(15) 0.04331(16) Uani 1 1 d . A .
C167 C 0.6035(4) 0.6445(3) 0.7271(2) 0.055(2) Uani 1 1 d . A .
C168 C 0.5602(4) 0.6770(3) 0.7377(2) 0.047(2) Uani 1 1 d . . .
C169 C 0.5936(4) 0.7160(3) 0.7449(2) 0.049(2) Uani 1 1 d . A .
C170 C 0.6695(4) 0.7216(4) 0.7434(2) 0.060(3) Uani 1 1 d . . .
H129 H 0.6915 0.7472 0.7506 0.071 Uiso 1 1 calc R A .
C171 C 0.7123(5) 0.6901(4) 0.7315(2) 0.060(3) Uani 1 1 d . A .
C172 C 0.7870(5) 0.6976(5) 0.7273(3) 0.075(3) Uani 1 1 d . . .
H130 H 0.8080 0.7241 0.7323 0.090 Uiso 1 1 calc R A .
C173 C 0.8284(6) 0.6661(6) 0.7159(4) 0.105(5) Uani 1 1 d . A .
H131 H 0.8795 0.6700 0.7148 0.126 Uiso 1 1 calc R . .
C174 C 0.7970(6) 0.6290(5) 0.7061(3) 0.094(5) Uani 1 1 d . . .
H132 H 0.8264 0.6087 0.6962 0.113 Uiso 1 1 calc R A .
C175 C 0.7254(5) 0.6197(4) 0.7099(3) 0.073(3) Uani 1 1 d . A .
H133 H 0.7059 0.5932 0.7037 0.087 Uiso 1 1 calc R . .
C176 C 0.6806(4) 0.6511(4) 0.7234(2) 0.059(3) Uani 1 1 d . . .
C177 C 0.5666(5) 0.6051(3) 0.7182(3) 0.062(3) Uani 1 1 d . . .
C178 C 0.5153(5) 0.6054(3) 0.6889(2) 0.049(2) Uani 1 1 d . A .
C179 C 0.4709(5) 0.5683(3) 0.6804(3) 0.054(2) Uani 1 1 d . . .
C180 C 0.4831(6) 0.5337(3) 0.7012(3) 0.076(3) Uani 1 1 d . A .
H134 H 0.4558 0.5090 0.6959 0.091 Uiso 1 1 calc R . .
C181 C 0.5347(6) 0.5335(3) 0.7301(3) 0.073(3) Uani 1 1 d . . .
C182 C 0.5455(9) 0.4982(4) 0.7499(4) 0.101(5) Uani 1 1 d . A .
H135 H 0.5207 0.4732 0.7431 0.121 Uiso 1 1 calc R . .
C183 C 0.5912(9) 0.4984(5) 0.7792(5) 0.114(6) Uani 1 1 d . . .
H136 H 0.5919 0.4753 0.7943 0.137 Uiso 1 1 calc R A .
C184 C 0.6381(7) 0.5341(4) 0.7868(4) 0.097(5) Uani 1 1 d . A .
H137 H 0.6741 0.5339 0.8054 0.116 Uiso 1 1 calc R . .
C185 C 0.6286(6) 0.5672(3) 0.7664(3) 0.065(3) Uani 1 1 d . . .
H138 H 0.6580 0.5911 0.7716 0.078 Uiso 1 1 calc R A .
C186 C 0.5783(5) 0.5689(3) 0.7380(3) 0.065(3) Uani 1 1 d . A .
O19 O 0.5086(3) 0.6388(2) 0.67033(17) 0.0537(17) Uani 1 1 d . . .
N13 N 0.3819(4) 0.6004(2) 0.63760(17) 0.0449(17) Uani 1 1 d . . .
C187 C 0.4157(5) 0.5655(3) 0.6512(2) 0.052(2) Uani 1 1 d . A .
C188 C 0.3924(5) 0.5263(3) 0.6386(2) 0.058(3) Uani 1 1 d . . .
H139 H 0.4138 0.5014 0.6477 0.070 Uiso 1 1 calc R A .
C189 C 0.3383(6) 0.5251(3) 0.6127(3) 0.066(3) Uani 1 1 d . A .
H140 H 0.3249 0.4989 0.6029 0.079 Uiso 1 1 calc R . .
C190 C 0.3025(5) 0.5605(3) 0.6005(2) 0.054(2) Uani 1 1 d . . .
H141 H 0.2630 0.5593 0.5835 0.065 Uiso 1 1 calc R A .
C191 C 0.3278(4) 0.5987(3) 0.6147(2) 0.047(2) Uani 1 1 d . A .
N14 N 0.3277(3) 0.6735(3) 0.61791(16) 0.0442(18) Uani 1 1 d . . .
C192 C 0.2955(4) 0.6386(3) 0.6030(2) 0.051(2) Uani 1 1 d . A .
C193 C 0.2367(4) 0.6430(4) 0.5783(2) 0.058(3) Uani 1 1 d . . .
H142 H 0.2133 0.6193 0.5680 0.070 Uiso 1 1 calc R A .
C194 C 0.2142(5) 0.6821(4) 0.5698(2) 0.061(3) Uani 1 1 d . A .
H143 H 0.1738 0.6859 0.5535 0.073 Uiso 1 1 calc R . .
C195 C 0.2497(4) 0.7166(3) 0.5845(2) 0.049(2) Uani 1 1 d . . .
H144 H 0.2350 0.7436 0.5768 0.059 Uiso 1 1 calc R A .
C196 C 0.3060(4) 0.7129(3) 0.60998(19) 0.0380(18) Uani 1 1 d . A .
C197 C 0.4114(5) 0.7471(3) 0.64599(19) 0.0421(19) Uani 1 1 d U A .
C198 C 0.3402(5) 0.7486(3) 0.62761(19) 0.046(2) Uani 1 1 d . . .
C199 C 0.3015(4) 0.7856(3) 0.6252(2) 0.045(2) Uani 1 1 d . A .
H145 H 0.2542 0.7858 0.6135 0.054 Uiso 1 1 calc R . .
C200 C 0.3302(5) 0.8237(3) 0.6398(2) 0.051(2) Uani 1 1 d . . .
C201 C 0.3988(6) 0.8222(3) 0.6558(2) 0.056(2) Uani 1 1 d . A .
H146 H 0.4197 0.8471 0.6651 0.067 Uiso 1 1 calc R . .
C202 C 0.4393(4) 0.7859(3) 0.65892(19) 0.044(2) Uani 1 1 d . . .
O20 O 0.4543(3) 0.7149(2) 0.65116(13) 0.0499(15) Uani 1 1 d . . .
C203 C 0.5122(5) 0.7862(4) 0.6759(2) 0.060(3) Uani 1 1 d . A .
H147 H 0.5381 0.7606 0.6780 0.073 Uiso 1 1 calc R . .
O21 O 0.5426(4) 0.8177(2) 0.68785(17) 0.0633(18) Uani 1 1 d D . .
C204 C 0.2859(6) 0.8641(4) 0.6354(3) 0.063(3) Uani 1 1 d . A .
C205 C 0.3066(8) 0.8953(4) 0.6614(3) 0.083(4) Uani 1 1 d . . .
H148 H 0.2967 0.8844 0.6837 0.125 Uiso 1 1 calc R A .
H149 H 0.2780 0.9208 0.6568 0.125 Uiso 1 1 calc R . .
H150 H 0.3589 0.9017 0.6612 0.125 Uiso 1 1 calc R . .
C206 C 0.2987(10) 0.8816(5) 0.6007(3) 0.115(6) Uani 1 1 d . . .
H151 H 0.2843 0.8609 0.5833 0.172 Uiso 1 1 calc R A .
H152 H 0.3506 0.8884 0.5998 0.172 Uiso 1 1 calc R . .
H153 H 0.2693 0.9069 0.5967 0.172 Uiso 1 1 calc R . .
C207 C 0.2045(7) 0.8570(5) 0.6387(4) 0.100(5) Uani 1 1 d . . .
H154 H 0.1858 0.8367 0.6216 0.150 Uiso 1 1 calc R A .
H155 H 0.1781 0.8833 0.6352 0.150 Uiso 1 1 calc R . .
H156 H 0.1974 0.8462 0.6613 0.150 Uiso 1 1 calc R . .
Pd8 Pd 0.47402(3) 0.668971(18) 0.569189(13) 0.03074(12) Uani 1 1 d . . .
C208 C 0.4723(5) 0.7586(3) 0.5706(2) 0.047(2) Uani 1 1 d . . .
C209 C 0.5402(5) 0.7618(3) 0.5884(2) 0.050(2) Uani 1 1 d . . .
C210 C 0.5692(6) 0.8033(3) 0.5911(3) 0.063(3) Uani 1 1 d . . .
H157 H 0.6169 0.8062 0.6021 0.075 Uiso 1 1 calc R . .
C211 C 0.5346(6) 0.8397(3) 0.5794(3) 0.058(3) Uani 1 1 d . . .
C212 C 0.4688(7) 0.8356(3) 0.5627(3) 0.067(3) Uani 1 1 d . . .
H158 H 0.4441 0.8600 0.5543 0.081 Uiso 1 1 calc R . .
C213 C 0.4331(6) 0.7954(3) 0.5568(2) 0.054(2) Uani 1 1 d . . .
O22 O 0.4311(3) 0.72443(18) 0.56286(12) 0.0402(12) Uani 1 1 d . . .
C214 C 0.3615(6) 0.7943(3) 0.5393(2) 0.057(3) Uani 1 1 d . . .
H159 H 0.3380 0.7680 0.5368 0.069 Uiso 1 1 calc R . .
O23 O 0.3283(5) 0.8249(2) 0.5274(2) 0.073(2) Uani 1 1 d D . .
C215 C 0.5719(8) 0.8825(3) 0.5865(3) 0.084(4) Uani 1 1 d . . .
C216 C 0.5277(10) 0.9178(4) 0.5686(4) 0.122(6) Uani 1 1 d . . .
H160 H 0.4784 0.9185 0.5766 0.183 Uiso 1 1 calc R . .
H161 H 0.5242 0.9131 0.5441 0.183 Uiso 1 1 calc R . .
H162 H 0.5522 0.9445 0.5738 0.183 Uiso 1 1 calc R . .
C217 C 0.5807(10) 0.8893(4) 0.6243(4) 0.113(6) Uani 1 1 d . . .
H163 H 0.5324 0.8892 0.6333 0.169 Uiso 1 1 calc R . .
H164 H 0.6046 0.9161 0.6291 0.169 Uiso 1 1 calc R . .
H165 H 0.6107 0.8669 0.6349 0.169 Uiso 1 1 calc R . .
C218 C 0.6502(9) 0.8822(5) 0.5750(6) 0.168(10) Uani 1 1 d . . .
H166 H 0.6727 0.9096 0.5792 0.252 Uiso 1 1 calc R . .
H167 H 0.6485 0.8759 0.5507 0.252 Uiso 1 1 calc R . .
H168 H 0.6792 0.8609 0.5877 0.252 Uiso 1 1 calc R . .
N15 N 0.5609(3) 0.6882(2) 0.59725(16) 0.0420(17) Uani 1 1 d . . .
C219 C 0.5782(4) 0.7284(3) 0.6034(2) 0.047(2) Uani 1 1 d . . .
C220 C 0.6376(6) 0.7355(4) 0.6292(3) 0.066(3) Uani 1 1 d . . .
H169 H 0.6503 0.7632 0.6358 0.079 Uiso 1 1 calc R . .
C221 C 0.6758(5) 0.7024(4) 0.6442(2) 0.067(3) Uani 1 1 d . . .
H170 H 0.7155 0.7074 0.6605 0.081 Uiso 1 1 calc R . .
C222 C 0.6569(4) 0.6626(4) 0.6357(2) 0.057(3) Uani 1 1 d . . .
H171 H 0.6835 0.6398 0.6457 0.068 Uiso 1 1 calc R . .
C223 C 0.5980(4) 0.6561(4) 0.61229(19) 0.053(2) Uani 1 1 d . . .
N16 N 0.5150(3) 0.6133(2) 0.57795(15) 0.0341(14) Uani 1 1 d . . .
C224 C 0.5732(4) 0.6143(3) 0.6026(2) 0.046(2) Uani 1 1 d . . .
C225 C 0.6019(5) 0.5774(3) 0.6154(2) 0.053(2) Uani 1 1 d . . .
H172 H 0.6427 0.5776 0.6318 0.064 Uiso 1 1 calc R . .
C226 C 0.5713(5) 0.5407(3) 0.6044(2) 0.056(2) Uani 1 1 d . . .
H173 H 0.5900 0.5153 0.6138 0.067 Uiso 1 1 calc R . .
C227 C 0.5133(5) 0.5398(3) 0.5798(3) 0.059(3) Uani 1 1 d . . .
H174 H 0.4935 0.5137 0.5722 0.071 Uiso 1 1 calc R . .
C228 C 0.4837(4) 0.5767(3) 0.5658(2) 0.0392(18) Uani 1 1 d . . .
C229 C 0.3338(4) 0.6098(2) 0.49873(16) 0.0299(12) Uani 1 1 d U . .
C230 C 0.3833(4) 0.6124(2) 0.52784(18) 0.0294(15) Uani 1 1 d . . .
C231 C 0.4275(4) 0.5772(2) 0.53782(18) 0.0339(16) Uani 1 1 d . . .
C232 C 0.4165(4) 0.5406(3) 0.5177(2) 0.0422(19) Uani 1 1 d . . .
H175 H 0.4458 0.5168 0.5236 0.051 Uiso 1 1 calc R . .
C233 C 0.3670(4) 0.5378(3) 0.4909(2) 0.0429(19) Uani 1 1 d . . .
C234 C 0.3575(5) 0.5003(3) 0.4712(3) 0.057(3) Uani 1 1 d . . .
H176 H 0.3841 0.4761 0.4783 0.069 Uiso 1 1 calc R . .
C235 C 0.3118(6) 0.4987(3) 0.4428(3) 0.066(3) Uani 1 1 d . . .
H177 H 0.3075 0.4736 0.4300 0.079 Uiso 1 1 calc R . .
C236 C 0.2712(5) 0.5331(3) 0.4322(3) 0.060(3) Uani 1 1 d . . .
H178 H 0.2392 0.5315 0.4122 0.072 Uiso 1 1 calc R . .
C237 C 0.2765(5) 0.5696(3) 0.4502(2) 0.050(2) Uani 1 1 d . . .
H179 H 0.2481 0.5931 0.4426 0.059 Uiso 1 1 calc R . .
C238 C 0.3249(4) 0.5725(3) 0.4804(2) 0.0398(18) Uani 1 1 d . . .
O24 O 0.3848(3) 0.64740(16) 0.54451(12) 0.0308(11) Uani 1 1 d . . .
C239 C 0.2963(3) 0.6490(2) 0.48833(16) 0.0283(9) Uani 1 1 d U B .
C240 C 0.3390(4) 0.6819(2) 0.47751(16) 0.0310(10) Uani 1 1 d U . .
C241 C 0.3066(4) 0.7215(2) 0.46861(16) 0.0338(9) Uani 1 1 d U B .
C242 C 0.2338(4) 0.7258(3) 0.4700(2) 0.0491(19) Uani 1 1 d U . .
H180 H 0.2132 0.7524 0.4649 0.059 Uiso 1 1 calc R B .
C243 C 0.1855(4) 0.6937(3) 0.4784(2) 0.0452(19) Uani 1 1 d . B .
C244 C 0.1101(5) 0.6987(4) 0.4797(2) 0.061(3) Uani 1 1 d . . .
H181 H 0.0886 0.7246 0.4730 0.073 Uiso 1 1 calc R B .
C245 C 0.0673(5) 0.6688(4) 0.4899(3) 0.068(3) Uani 1 1 d . B .
H182 H 0.0164 0.6737 0.4911 0.081 Uiso 1 1 calc R . .
C246 C 0.0975(5) 0.6295(4) 0.4989(3) 0.063(3) Uani 1 1 d . . .
H183 H 0.0667 0.6076 0.5055 0.076 Uiso 1 1 calc R B .
C247 C 0.1705(4) 0.6230(3) 0.4981(2) 0.044(2) Uani 1 1 d . B .
H184 H 0.1902 0.5965 0.5043 0.053 Uiso 1 1 calc R . .
C248 C 0.2185(4) 0.6550(3) 0.48816(18) 0.0373(14) Uani 1 1 d U . .
Pd9 Pd 0.48276(6) 0.71657(4) 0.48589(3) 0.03346(19) Uani 0.765(3) 1 d PDU B 1
O25 O 0.4083(4) 0.6732(2) 0.4745(3) 0.0356(15) Uani 0.765(3) 1 d PDU B 1
N17 N 0.4175(5) 0.7623(3) 0.4696(2) 0.0367(11) Uani 0.765(3) 1 d PDU B 1
C249 C 0.3457(5) 0.7580(3) 0.4592(3) 0.0398(13) Uani 0.765(3) 1 d PDU B 1
C250 C 0.3113(6) 0.7913(4) 0.4416(3) 0.0503(18) Uani 0.765(3) 1 d PDU B 1
H185 H 0.2611 0.7890 0.4338 0.060 Uiso 0.765(3) 1 calc PR B 1
C251 C 0.3489(7) 0.8273(4) 0.4354(4) 0.056(2) Uani 0.765(3) 1 d PDU B 1
H186 H 0.3255 0.8493 0.4228 0.067 Uiso 0.765(3) 1 calc PR B 1
C252 C 0.4218(8) 0.8310(4) 0.4479(3) 0.056(2) Uani 0.765(3) 1 d PDU B 1
H187 H 0.4480 0.8561 0.4451 0.067 Uiso 0.765(3) 1 calc PR B 1
C253 C 0.4549(6) 0.7980(3) 0.4642(3) 0.0433(15) Uani 0.765(3) 1 d PDU B 1
N18 N 0.5554(4) 0.7606(3) 0.4945(2) 0.0411(11) Uani 0.765(3) 1 d PDU B 1
C254 C 0.5332(6) 0.7979(3) 0.4794(2) 0.0428(14) Uani 0.765(3) 1 d PDU B 1
C255 C 0.5773(7) 0.8314(4) 0.4805(3) 0.0559(19) Uani 0.765(3) 1 d PDU B 1
H188 H 0.5599 0.8576 0.4723 0.067 Uiso 0.765(3) 1 calc PR B 1
C256 C 0.6491(7) 0.8268(4) 0.4941(3) 0.061(2) Uani 0.765(3) 1 d PDU B 1
H189 H 0.6813 0.8500 0.4950 0.073 Uiso 0.765(3) 1 calc PR B 1
C257 C 0.6718(7) 0.7918(5) 0.5052(4) 0.0581(19) Uani 0.765(3) 1 d PDU B 1
H190 H 0.7221 0.7890 0.5126 0.070 Uiso 0.765(3) 1 calc PR B 1
C258 C 0.6261(5) 0.7566(4) 0.5071(3) 0.0452(14) Uani 0.765(3) 1 d PDU B 1
C259 C 0.6152(5) 0.6778(4) 0.5152(3) 0.0372(11) Uani 0.765(3) 1 d PDU B 1
C260 C 0.6527(5) 0.7152(4) 0.5218(2) 0.0416(10) Uani 0.765(3) 1 d PDU B 1
C261 C 0.7198(5) 0.7138(5) 0.5411(2) 0.0513(14) Uani 0.765(3) 1 d PDU B 1
H191 H 0.7439 0.7399 0.5446 0.062 Uiso 0.765(3) 1 calc PR B 1
C262 C 0.7529(6) 0.6827(5) 0.5545(3) 0.0607(11) Uani 0.765(3) 1 d PDU B 1
C263 C 0.7208(6) 0.6431(5) 0.5473(3) 0.0563(16) Uani 0.765(3) 1 d PDU B 1
H192 H 0.7428 0.6179 0.5556 0.068 Uiso 0.765(3) 1 calc PR B 1
C264 C 0.6553(5) 0.6437(4) 0.5275(2) 0.0408(11) Uani 0.765(3) 1 d PDU B 1
O26 O 0.5507(3) 0.6713(2) 0.49697(16) 0.0328(10) Uani 0.765(3) 1 d PDU B 1
C265 C 0.6197(6) 0.6001(4) 0.5220(3) 0.0501(17) Uani 0.765(3) 1 d PDU B 1
H193 H 0.5719 0.5988 0.5109 0.060 Uiso 0.765(3) 1 calc PR B 1
O27 O 0.6488(5) 0.5678(3) 0.5309(3) 0.0592(16) Uani 0.765(3) 1 d PDU B 1
C266 C 0.8320(7) 0.6846(6) 0.5738(3) 0.0809(11) Uani 0.765(3) 1 d PDU B 1
C267 C 0.8369(6) 0.6541(6) 0.6036(3) 0.0766(15) Uani 0.765(3) 1 d PDU B 1
H194 H 0.8009 0.6618 0.6195 0.115 Uiso 0.765(3) 1 calc PR B 1
H195 H 0.8862 0.6551 0.6151 0.115 Uiso 0.765(3) 1 calc PR B 1
H196 H 0.8268 0.6258 0.5952 0.115 Uiso 0.765(3) 1 calc PR B 1
C268 C 0.8879(7) 0.6727(7) 0.5493(4) 0.098(2) Uani 0.765(3) 1 d PDU B 1
H197 H 0.8857 0.6926 0.5305 0.148 Uiso 0.765(3) 1 calc PR B 1
H198 H 0.8770 0.6447 0.5404 0.148 Uiso 0.765(3) 1 calc PR B 1
H199 H 0.9370 0.6730 0.5610 0.148 Uiso 0.765(3) 1 calc PR B 1
C269 C 0.8459(8) 0.7261(6) 0.5869(4) 0.097(2) Uani 0.765(3) 1 d PDU B 1
H200 H 0.8109 0.7327 0.6036 0.145 Uiso 0.765(3) 1 calc PR B 1
H201 H 0.8405 0.7462 0.5682 0.145 Uiso 0.765(3) 1 calc PR B 1
H202 H 0.8959 0.7276 0.5976 0.145 Uiso 0.765(3) 1 calc PR B 1
Pd10 Pd 0.4968(2) 0.71008(15) 0.49003(12) 0.03346(19) Uani 0.235(3) 1 d PDU B 2
O28 O 0.4139(11) 0.6718(7) 0.4802(12) 0.0356(15) Uani 0.235(3) 1 d PDU B 2
N19 N 0.4371(9) 0.7596(5) 0.4759(8) 0.0367(11) Uani 0.235(3) 1 d PDU B 2
C270 C 0.3666(12) 0.7584(8) 0.4629(10) 0.0398(13) Uani 0.235(3) 1 d PDU B 2
C271 C 0.3392(16) 0.7911(9) 0.4424(10) 0.0503(18) Uani 0.235(3) 1 d PDU B 2
H203 H 0.2939 0.7884 0.4291 0.060 Uiso 0.235(3) 1 calc PR B 2
C272 C 0.3797(17) 0.8277(9) 0.4418(11) 0.056(2) Uani 0.235(3) 1 d PDU B 2
H204 H 0.3598 0.8517 0.4305 0.067 Uiso 0.235(3) 1 calc PR B 2
C273 C 0.4498(17) 0.8286(8) 0.4580(11) 0.056(2) Uani 0.235(3) 1 d PDU B 2
H205 H 0.4778 0.8535 0.4579 0.067 Uiso 0.235(3) 1 calc PR B 2
C274 C 0.4786(11) 0.7942(7) 0.4739(9) 0.0433(15) Uani 0.235(3) 1 d PDU B 2
N20 N 0.5763(9) 0.7503(5) 0.4958(7) 0.0411(11) Uani 0.235(3) 1 d PDU B 2
C275 C 0.5560(11) 0.7911(6) 0.4900(9) 0.0428(14) Uani 0.235(3) 1 d PDU B 2
C276 C 0.6039(14) 0.8230(8) 0.4935(10) 0.0559(19) Uani 0.235(3) 1 d PDU B 2
H206 H 0.5893 0.8510 0.4893 0.067 Uiso 0.235(3) 1 calc PR B 2
C277 C 0.6757(15) 0.8126(9) 0.5035(12) 0.061(2) Uani 0.235(3) 1 d PDU B 2
H207 H 0.7130 0.8331 0.5030 0.073 Uiso 0.235(3) 1 calc PR B 2
C278 C 0.6924(14) 0.7757(9) 0.5134(11) 0.0581(19) Uani 0.235(3) 1 d PDU B 2
H208 H 0.7422 0.7700 0.5203 0.070 Uiso 0.235(3) 1 calc PR B 2
C279 C 0.6413(12) 0.7425(7) 0.5148(9) 0.0452(14) Uani 0.235(3) 1 d PDU B 2
C280 C 0.6222(10) 0.6624(6) 0.5177(8) 0.0372(11) Uani 0.235(3) 1 d PDU B 2
C281 C 0.6621(12) 0.6981(7) 0.5250(7) 0.0416(10) Uani 0.235(3) 1 d PDU B 2
C282 C 0.7258(14) 0.6948(9) 0.5475(8) 0.0513(14) Uani 0.235(3) 1 d PDU B 2
H209 H 0.7468 0.7199 0.5564 0.062 Uiso 0.235(3) 1 calc PR B 2
C283 C 0.7565(12) 0.6611(9) 0.5567(8) 0.0607(11) Uani 0.235(3) 1 d PDU B 2
C284 C 0.7249(13) 0.6225(9) 0.5447(10) 0.0563(16) Uani 0.235(3) 1 d PDU B 2
H210 H 0.7506 0.5968 0.5465 0.068 Uiso 0.235(3) 1 calc PR B 2
C285 C 0.6541(12) 0.6257(7) 0.5302(8) 0.0408(11) Uani 0.235(3) 1 d PDU B 2
O29 O 0.5533(9) 0.6608(5) 0.5035(7) 0.0328(10) Uani 0.235(3) 1 d PDU B 2
C286 C 0.6149(17) 0.5843(7) 0.5198(11) 0.0501(17) Uani 0.235(3) 1 d PDU B 2
H211 H 0.5688 0.5851 0.5071 0.060 Uiso 0.235(3) 1 calc PR B 2
O30 O 0.6421(19) 0.5509(8) 0.5278(10) 0.0592(16) Uani 0.235(3) 1 d PDU B 2
C287 C 0.8359(12) 0.6585(11) 0.5759(7) 0.0809(11) Uani 0.235(3) 1 d PDU B 2
C288 C 0.8380(19) 0.6227(13) 0.6016(9) 0.0766(15) Uani 0.235(3) 1 d PDU B 2
H212 H 0.8053 0.6291 0.6193 0.115 Uiso 0.235(3) 1 calc PR B 2
H213 H 0.8881 0.6193 0.6118 0.115 Uiso 0.235(3) 1 calc PR B 2
H214 H 0.8221 0.5969 0.5901 0.115 Uiso 0.235(3) 1 calc PR B 2
C289 C 0.8915(19) 0.6503(18) 0.5504(10) 0.098(2) Uani 0.235(3) 1 d PDU B 2
H215 H 0.8881 0.6721 0.5330 0.148 Uiso 0.235(3) 1 calc PR B 2
H216 H 0.8818 0.6232 0.5397 0.148 Uiso 0.235(3) 1 calc PR B 2
H217 H 0.9408 0.6504 0.5620 0.148 Uiso 0.235(3) 1 calc PR B 2
C290 C 0.851(2) 0.6957(13) 0.5958(11) 0.097(2) Uani 0.235(3) 1 d PDU B 2
H218 H 0.8145 0.6988 0.6124 0.145 Uiso 0.235(3) 1 calc PR B 2
H219 H 0.8496 0.7201 0.5809 0.145 Uiso 0.235(3) 1 calc PR B 2
H220 H 0.9000 0.6935 0.6077 0.145 Uiso 0.235(3) 1 calc PR B 2
Pd11 Pd 0.55785(3) 0.70825(2) 0.414635(13) 0.03592(14) Uani 1 1 d . . .
Pd12 Pd 0.73813(3) 0.720555(19) 0.369948(12) 0.02998(11) Uani 1 1 d . B .
C291 C 0.6928(4) 0.6723(3) 0.44579(18) 0.0467(11) Uani 1 1 d U . .
C292 C 0.6641(5) 0.6310(3) 0.4410(2) 0.0527(13) Uani 1 1 d U B .
C293 C 0.7139(5) 0.5973(4) 0.4475(2) 0.0573(14) Uani 1 1 d U . .
H221 H 0.6950 0.5698 0.4455 0.069 Uiso 1 1 calc R B .
C294 C 0.7883(5) 0.6021(4) 0.4565(2) 0.0598(14) Uani 1 1 d U B .
C295 C 0.8120(5) 0.6419(4) 0.4627(3) 0.070(2) Uani 1 1 d U . .
H222 H 0.8612 0.6460 0.4716 0.084 Uiso 1 1 calc R B .
C296 C 0.7685(5) 0.6761(4) 0.45688(19) 0.0532(12) Uani 1 1 d U B .
O31 O 0.6561(3) 0.7065(2) 0.44015(11) 0.0440(10) Uani 1 1 d U B .
C297 C 0.7939(5) 0.7166(4) 0.4636(2) 0.0594(15) Uani 1 1 d U . .
H223 H 0.7601 0.7389 0.4602 0.071 Uiso 1 1 calc R B .
O32 O 0.8588(4) 0.7252(3) 0.47374(18) 0.080(2) Uani 1 1 d U B .
C298 C 0.8352(6) 0.5622(4) 0.4641(2) 0.071(3) Uani 1 1 d . . .
C299 C 0.9182(6) 0.5749(5) 0.4659(3) 0.091(4) Uani 1 1 d . B .
H224 H 0.9277 0.5963 0.4833 0.136 Uiso 1 1 calc R . .
H225 H 0.9300 0.5859 0.4439 0.136 Uiso 1 1 calc R . .
H226 H 0.9486 0.5504 0.4716 0.136 Uiso 1 1 calc R . .
C300 C 0.8171(7) 0.5449(5) 0.4989(3) 0.108(5) Uani 1 1 d . B .
H227 H 0.8261 0.5664 0.5162 0.163 Uiso 1 1 calc R . .
H228 H 0.8482 0.5207 0.5047 0.163 Uiso 1 1 calc R . .
H229 H 0.7656 0.5365 0.4978 0.163 Uiso 1 1 calc R . .
C301 C 0.8217(7) 0.5285(4) 0.4382(3) 0.087(4) Uani 1 1 d . B .
H230 H 0.8531 0.5046 0.4444 0.130 Uiso 1 1 calc R . .
H231 H 0.8327 0.5390 0.4159 0.130 Uiso 1 1 calc R . .
H232 H 0.7702 0.5199 0.4374 0.130 Uiso 1 1 calc R . .
N21 N 0.5390(4) 0.6482(2) 0.41977(14) 0.0434(12) Uani 1 1 d U B .
C302 C 0.5858(5) 0.6197(3) 0.43429(18) 0.0451(11) Uani 1 1 d U . .
C303 C 0.5580(6) 0.5809(3) 0.4408(2) 0.0553(16) Uani 1 1 d U B .
H233 H 0.5906 0.5606 0.4507 0.066 Uiso 1 1 calc R . .
C304 C 0.4874(6) 0.5701(3) 0.4338(2) 0.0589(17) Uani 1 1 d U . .
H234 H 0.4704 0.5431 0.4390 0.071 Uiso 1 1 calc R B .
C305 C 0.4405(5) 0.5998(3) 0.4189(2) 0.0486(18) Uani 1 1 d U B .
H235 H 0.3909 0.5929 0.4124 0.058 Uiso 1 1 calc R . .
C306 C 0.4658(4) 0.6388(3) 0.41351(18) 0.045(2) Uani 1 1 d . . .
N22 N 0.4577(3) 0.7086(2) 0.39189(14) 0.0374(15) Uani 1 1 d . B .
C307 C 0.4220(4) 0.6725(3) 0.39885(18) 0.0379(17) Uani 1 1 d . B .
C308 C 0.3462(4) 0.6721(3) 0.3908(2) 0.050(2) Uani 1 1 d . . .
H236 H 0.3195 0.6477 0.3954 0.061 Uiso 1 1 calc R B .
C309 C 0.3099(4) 0.7048(3) 0.3768(2) 0.049(2) Uani 1 1 d . B .
H237 H 0.2583 0.7038 0.3721 0.059 Uiso 1 1 calc R . .
C310 C 0.3489(4) 0.7401(3) 0.3695(2) 0.050(2) Uani 1 1 d . . .
H238 H 0.3243 0.7636 0.3595 0.060 Uiso 1 1 calc R B .
C311 C 0.4245(4) 0.7410(3) 0.37672(18) 0.0391(18) Uani 1 1 d . B .
C312 C 0.5737(4) 0.8243(2) 0.37265(19) 0.0369(17) Uani 1 1 d . B .
C313 C 0.5378(4) 0.7888(3) 0.38401(17) 0.0364(17) Uani 1 1 d . . .
C314 C 0.4692(4) 0.7775(2) 0.36668(18) 0.0355(16) Uani 1 1 d . B .
C315 C 0.4432(4) 0.7989(3) 0.33793(19) 0.0418(19) Uani 1 1 d . . .
H239 H 0.3998 0.7895 0.3255 0.050 Uiso 1 1 calc R B .
C316 C 0.4793(5) 0.8342(3) 0.3267(2) 0.0444(19) Uani 1 1 d . B .
C317 C 0.4519(6) 0.8550(3) 0.2962(3) 0.060(3) Uani 1 1 d . . .
H240 H 0.4099 0.8448 0.2831 0.072 Uiso 1 1 calc R B .
C318 C 0.4874(7) 0.8894(3) 0.2865(3) 0.072(3) Uani 1 1 d . B .
H241 H 0.4689 0.9041 0.2668 0.086 Uiso 1 1 calc R . .
C319 C 0.5504(6) 0.9038(3) 0.3047(3) 0.069(3) Uani 1 1 d . . .
H242 H 0.5739 0.9280 0.2971 0.082 Uiso 1 1 calc R B .
C320 C 0.5789(5) 0.8846(3) 0.3327(2) 0.051(2) Uani 1 1 d . B .
H243 H 0.6218 0.8954 0.3447 0.061 Uiso 1 1 calc R . .
C321 C 0.5450(5) 0.8479(3) 0.3447(2) 0.047(2) Uani 1 1 d . . .
O33 O 0.5681(3) 0.76918(18) 0.41068(13) 0.0403(13) Uani 1 1 d . B .
C322 C 0.6478(5) 0.8336(3) 0.3898(2) 0.0421(18) Uani 1 1 d . . .
C323 C 0.7044(4) 0.8064(2) 0.38507(18) 0.0347(16) Uani 1 1 d . B .
C324 C 0.7764(4) 0.8131(3) 0.4017(2) 0.0420(19) Uani 1 1 d . . .
C325 C 0.7865(5) 0.8485(3) 0.4221(2) 0.050(2) Uani 1 1 d . B .
H244 H 0.8334 0.8534 0.4334 0.060 Uiso 1 1 calc R . .
C326 C 0.7300(5) 0.8771(3) 0.4265(2) 0.049(2) Uani 1 1 d . . .
C327 C 0.7434(7) 0.9118(3) 0.4482(3) 0.074(3) Uani 1 1 d . B .
H245 H 0.7911 0.9164 0.4588 0.089 Uiso 1 1 calc R . .
C328 C 0.6883(6) 0.9386(3) 0.4540(3) 0.069(3) Uani 1 1 d . . .
H246 H 0.6969 0.9620 0.4684 0.083 Uiso 1 1 calc R B .
C329 C 0.6180(6) 0.9308(3) 0.4380(3) 0.067(3) Uani 1 1 d . B .
H247 H 0.5794 0.9494 0.4422 0.081 Uiso 1 1 calc R . .
C330 C 0.6029(5) 0.8983(3) 0.4172(2) 0.051(2) Uani 1 1 d . . .
H248 H 0.5548 0.8943 0.4068 0.061 Uiso 1 1 calc R B .
C331 C 0.6605(5) 0.8698(3) 0.4108(2) 0.046(2) Uani 1 1 d . B .
O34 O 0.6876(3) 0.77453(17) 0.36358(15) 0.0408(13) Uani 1 1 d . . .
N23 N 0.8287(3) 0.7450(2) 0.39106(16) 0.0389(15) Uani 1 1 d . . .
C332 C 0.8393(4) 0.7848(3) 0.39964(19) 0.0380(17) Uani 1 1 d . B .
C333 C 0.9117(5) 0.7989(3) 0.4087(3) 0.061(3) Uani 1 1 d . . .
H249 H 0.9208 0.8276 0.4131 0.073 Uiso 1 1 calc R B .
C334 C 0.9684(5) 0.7709(4) 0.4109(3) 0.072(3) Uani 1 1 d . B .
H250 H 1.0165 0.7799 0.4182 0.087 Uiso 1 1 calc R . .
C335 C 0.9555(5) 0.7294(3) 0.4027(3) 0.059(3) Uani 1 1 d . . .
H251 H 0.9944 0.7097 0.4045 0.071 Uiso 1 1 calc R B .
C336 C 0.8859(4) 0.7172(3) 0.39197(19) 0.0418(18) Uani 1 1 d . B .
N24 N 0.7934(3) 0.66771(18) 0.37375(13) 0.0287(12) Uani 1 1 d . . .
C337 C 0.8669(4) 0.6741(3) 0.38299(18) 0.0388(17) Uani 1 1 d . B .
C338 C 0.9166(4) 0.6425(3) 0.3829(2) 0.047(2) Uani 1 1 d . . .
H252 H 0.9667 0.6471 0.3901 0.056 Uiso 1 1 calc R B .
C339 C 0.8922(5) 0.6035(3) 0.3722(3) 0.054(2) Uani 1 1 d . B .
H253 H 0.9260 0.5812 0.3709 0.064 Uiso 1 1 calc R . .
C340 C 0.8199(5) 0.5972(3) 0.3634(2) 0.048(2) Uani 1 1 d . . .
H254 H 0.8036 0.5704 0.3559 0.057 Uiso 1 1 calc R B .
C341 C 0.7682(4) 0.6297(2) 0.36510(18) 0.0344(16) Uani 1 1 d . B .
C342 C 0.6379(3) 0.6526(2) 0.34708(14) 0.0255(13) Uani 1 1 d U B .
C343 C 0.6903(4) 0.6231(3) 0.35685(18) 0.0371(17) Uani 1 1 d . . .
C344 C 0.6668(6) 0.5809(2) 0.35807(17) 0.045(2) Uani 1 1 d . B .
H255 H 0.7014 0.5602 0.3655 0.054 Uiso 1 1 calc R . .
C345 C 0.5929(5) 0.5683(3) 0.3485(2) 0.048(2) Uani 1 1 d . . .
C346 C 0.5450(5) 0.6001(3) 0.33686(18) 0.0422(19) Uani 1 1 d . B .
H256 H 0.4967 0.5928 0.3285 0.051 Uiso 1 1 calc R . .
C347 C 0.5643(4) 0.6412(2) 0.33693(18) 0.0354(16) Uani 1 1 d . . .
O35 O 0.6495(3) 0.69479(17) 0.34720(12) 0.0336(11) Uani 1 1 d . . .
C348 C 0.5099(4) 0.6719(3) 0.32576(17) 0.0398(18) Uani 1 1 d . B .
H257 H 0.5234 0.7003 0.3285 0.048 Uiso 1 1 calc R . .
O36 O 0.4485(3) 0.6648(2) 0.31326(15) 0.0508(15) Uani 1 1 d . . .
C349 C 0.5761(6) 0.5217(3) 0.3480(2) 0.057(3) Uani 1 1 d . B .
C350 C 0.4915(6) 0.5155(3) 0.3456(3) 0.074(3) Uani 1 1 d . . .
H258 H 0.4803 0.4856 0.3454 0.111 Uiso 1 1 calc R B .
H259 H 0.4698 0.5283 0.3247 0.111 Uiso 1 1 calc R . .
H260 H 0.4712 0.5286 0.3652 0.111 Uiso 1 1 calc R . .
C351 C 0.6078(6) 0.5028(3) 0.3166(2) 0.060(3) Uani 1 1 d . . .
H261 H 0.5971 0.4729 0.3155 0.090 Uiso 1 1 calc R B .
H262 H 0.6610 0.5071 0.3181 0.090 Uiso 1 1 calc R . .
H263 H 0.5857 0.5164 0.2962 0.090 Uiso 1 1 calc R . .
C352 C 0.6074(7) 0.4996(3) 0.3794(3) 0.066(3) Uani 1 1 d . . .
H264 H 0.5942 0.4701 0.3780 0.099 Uiso 1 1 calc R B .
H265 H 0.5877 0.5120 0.3994 0.099 Uiso 1 1 calc R . .
H266 H 0.6609 0.5024 0.3812 0.099 Uiso 1 1 calc R . .
Pd13 Pd 0.80337(3) 0.72052(2) 0.295724(13) 0.03140(12) Uani 1 1 d . . .
Pd14 Pd 0.88144(3) 0.645578(19) 0.227454(13) 0.03202(13) Uani 1 1 d . B .
C353 C 0.7245(3) 0.6431(2) 0.27547(14) 0.0239(13) Uani 1 1 d . . .
C354 C 0.6620(4) 0.6644(3) 0.26374(19) 0.0353(16) Uani 1 1 d . B .
C355 C 0.6078(4) 0.6430(3) 0.24554(18) 0.0358(17) Uani 1 1 d . . .
H267 H 0.5658 0.6581 0.2369 0.043 Uiso 1 1 calc R B .
C356 C 0.6102(4) 0.5994(3) 0.23871(18) 0.0379(17) Uani 1 1 d . B .
C357 C 0.6712(4) 0.5787(2) 0.25213(19) 0.0368(17) Uani 1 1 d . . .
H268 H 0.6745 0.5495 0.2489 0.044 Uiso 1 1 calc R B .
C358 C 0.7306(4) 0.6001(2) 0.27096(19) 0.0350(16) Uani 1 1 d . B .
O37 O 0.7839(3) 0.65981(17) 0.29331(12) 0.0355(12) Uani 1 1 d . B .
C359 C 0.7922(4) 0.5763(3) 0.28404(19) 0.0390(19) Uani 1 1 d . . .
H269 H 0.8323 0.5912 0.2948 0.047 Uiso 1 1 calc R B .
O38 O 0.7980(3) 0.53828(19) 0.28259(17) 0.0523(15) Uani 1 1 d . B .
C360 C 0.5448(4) 0.5774(3) 0.2208(2) 0.046(2) Uani 1 1 d . . .
C361 C 0.5637(5) 0.5321(3) 0.2113(3) 0.059(3) Uani 1 1 d . B .
H270 H 0.5212 0.5193 0.1988 0.089 Uiso 1 1 calc R . .
H271 H 0.5767 0.5161 0.2320 0.089 Uiso 1 1 calc R . .
H272 H 0.6051 0.5322 0.1971 0.089 Uiso 1 1 calc R . .
C362 C 0.4822(5) 0.5758(3) 0.2441(2) 0.050(2) Uani 1 1 d . B .
H273 H 0.4396 0.5624 0.2322 0.075 Uiso 1 1 calc R . .
H274 H 0.4693 0.6042 0.2504 0.075 Uiso 1 1 calc R . .
H275 H 0.4976 0.5599 0.2645 0.075 Uiso 1 1 calc R . .
C363 C 0.5178(5) 0.5997(3) 0.1887(2) 0.056(2) Uani 1 1 d . B .
H276 H 0.4764 0.5845 0.1775 0.084 Uiso 1 1 calc R . .
H277 H 0.5574 0.6013 0.1735 0.084 Uiso 1 1 calc R . .
H278 H 0.5022 0.6279 0.1942 0.084 Uiso 1 1 calc R . .
N25 N 0.7013(3) 0.73638(19) 0.28082(16) 0.0336(14) Uani 1 1 d . B .
C364 C 0.6485(4) 0.7098(2) 0.26991(17) 0.0324(16) Uani 1 1 d . . .
C365 C 0.5760(4) 0.7261(3) 0.2651(2) 0.0408(18) Uani 1 1 d . B .
H279 H 0.5366 0.7079 0.2585 0.049 Uiso 1 1 calc R . .
C366 C 0.5619(4) 0.7675(3) 0.26989(19) 0.0419(19) Uani 1 1 d . . .
H280 H 0.5135 0.7779 0.2657 0.050 Uiso 1 1 calc R B .
C367 C 0.6192(4) 0.7943(3) 0.2809(2) 0.0410(18) Uani 1 1 d . B .
H281 H 0.6107 0.8231 0.2846 0.049 Uiso 1 1 calc R . .
C368 C 0.6887(4) 0.7773(2) 0.28643(17) 0.0361(17) Uani 1 1 d . . .
N26 N 0.8181(4) 0.7808(2) 0.30046(16) 0.0393(15) Uani 1 1 d . B .
C369 C 0.7522(5) 0.8027(3) 0.2982(2) 0.0406(18) Uani 1 1 d . B .
C370 C 0.7506(5) 0.8435(3) 0.3063(2) 0.049(2) Uani 1 1 d . . .
H282 H 0.7056 0.8583 0.3044 0.059 Uiso 1 1 calc R B .
C371 C 0.8142(6) 0.8637(3) 0.3174(3) 0.065(3) Uani 1 1 d . B .
H283 H 0.8132 0.8921 0.3241 0.078 Uiso 1 1 calc R . .
C372 C 0.8797(5) 0.8422(3) 0.3186(3) 0.057(2) Uani 1 1 d . . .
H284 H 0.9237 0.8558 0.3267 0.068 Uiso 1 1 calc R B .
C373 C 0.8823(5) 0.8009(3) 0.3080(2) 0.048(2) Uani 1 1 d . B .
C374 C 1.0274(4) 0.7148(3) 0.30715(19) 0.044(2) Uani 1 1 d . B .
C375 C 0.9586(4) 0.7331(3) 0.30949(17) 0.041(2) Uani 1 1 d . . .
C376 C 0.9516(4) 0.7779(3) 0.30558(19) 0.045(2) Uani 1 1 d . B .
C377 C 1.0130(5) 0.8009(3) 0.2997(2) 0.054(2) Uani 1 1 d . . .
H285 H 1.0077 0.8300 0.2960 0.065 Uiso 1 1 calc R B .
C378 C 1.0813(5) 0.7835(3) 0.2988(2) 0.055(2) Uani 1 1 d . B .
C379 C 1.1446(5) 0.8073(4) 0.2920(2) 0.062(3) Uani 1 1 d . . .
H286 H 1.1394 0.8365 0.2888 0.075 Uiso 1 1 calc R B .
C380 C 1.2103(5) 0.7904(4) 0.2901(3) 0.066(3) Uani 1 1 d . B .
H287 H 1.2504 0.8071 0.2846 0.079 Uiso 1 1 calc R . .
C381 C 1.2199(5) 0.7481(4) 0.2960(2) 0.067(3) Uani 1 1 d . . .
H288 H 1.2678 0.7368 0.2962 0.081 Uiso 1 1 calc R B .
C382 C 1.1618(4) 0.7217(4) 0.30183(19) 0.057(3) Uani 1 1 d . B .
H289 H 1.1697 0.6927 0.3052 0.068 Uiso 1 1 calc R . .
C383 C 1.0906(4) 0.7389(3) 0.30264(19) 0.049(2) Uani 1 1 d . . .
O39 O 0.9036(3) 0.70771(16) 0.31477(12) 0.0359(12) Uani 1 1 d . B .
C384 C 1.0330(4) 0.6687(3) 0.30855(18) 0.0418(19) Uani 1 1 d . . .
C385 C 0.9970(4) 0.6461(3) 0.28113(17) 0.0410(19) Uani 1 1 d . B .
C386 C 0.9994(4) 0.6010(3) 0.28225(18) 0.0369(17) Uani 1 1 d . . .
C387 C 1.0326(5) 0.5812(3) 0.3108(2) 0.052(2) Uani 1 1 d . B .
H290 H 1.0344 0.5516 0.3113 0.062 Uiso 1 1 calc R . .
C388 C 1.0633(4) 0.6035(3) 0.3386(2) 0.048(2) Uani 1 1 d . . .
C389 C 1.0894(5) 0.5827(4) 0.3687(2) 0.058(2) Uani 1 1 d . B .
H291 H 1.0870 0.5532 0.3700 0.069 Uiso 1 1 calc R . .
C390 C 1.1183(5) 0.6056(4) 0.3962(3) 0.069(3) Uani 1 1 d . . .
H292 H 1.1339 0.5919 0.4167 0.083 Uiso 1 1 calc R B .
C391 C 1.1245(5) 0.6478(4) 0.3936(2) 0.060(3) Uani 1 1 d . B .
H293 H 1.1486 0.6623 0.4122 0.072 Uiso 1 1 calc R . .
C392 C 1.0983(4) 0.6707(4) 0.3660(2) 0.058(3) Uani 1 1 d . . .
H294 H 1.1014 0.7003 0.3659 0.070 Uiso 1 1 calc R B .
C393 C 1.0652(4) 0.6476(3) 0.3367(2) 0.051(2) Uani 1 1 d . B .
O40 O 0.9665(3) 0.66754(17) 0.25579(12) 0.0368(12) Uani 1 1 d . . .
N27 N 0.9139(3) 0.5873(2) 0.23394(16) 0.0415(16) Uani 1 1 d . . .
C394 C 0.9681(4) 0.5744(3) 0.2549(2) 0.0409(18) Uani 1 1 d . B .
C395 C 0.9949(5) 0.5329(3) 0.2509(2) 0.052(2) Uani 1 1 d . . .
H295 H 1.0363 0.5232 0.2646 0.063 Uiso 1 1 calc R B .
C396 C 0.9601(6) 0.5072(3) 0.2270(3) 0.061(3) Uani 1 1 d . B .
H296 H 0.9783 0.4799 0.2238 0.073 Uiso 1 1 calc R . .
C397 C 0.9000(5) 0.5206(3) 0.2080(2) 0.052(2) Uani 1 1 d . . .
H297 H 0.8740 0.5022 0.1925 0.062 Uiso 1 1 calc R B .
C398 C 0.8773(5) 0.5604(3) 0.2113(2) 0.046(2) Uani 1 1 d . B .
N28 N 0.8013(3) 0.6211(2) 0.19679(16) 0.0405(16) Uani 1 1 d . . .
C399 C 0.8138(4) 0.5793(3) 0.1924(2) 0.0407(18) Uani 1 1 d . B .
C400 C 0.7669(5) 0.5559(3) 0.1698(2) 0.049(2) Uani 1 1 d . . .
H298 H 0.7732 0.5268 0.1669 0.058 Uiso 1 1 calc R B .
C401 C 0.7098(5) 0.5782(4) 0.1517(2) 0.060(3) Uani 1 1 d . B .
H299 H 0.6768 0.5637 0.1361 0.072 Uiso 1 1 calc R . .
C402 C 0.7011(5) 0.6192(3) 0.1559(2) 0.053(2) Uani 1 1 d . . .
H300 H 0.6647 0.6338 0.1423 0.064 Uiso 1 1 calc R B .
C403 C 0.7465(4) 0.6409(3) 0.1810(2) 0.044(2) Uani 1 1 d . B .
C404 C 0.7842(4) 0.7133(3) 0.20363(17) 0.0339(12) Uani 1 1 d U B .
C405 C 0.7325(4) 0.6857(3) 0.18687(19) 0.0405(14) Uani 1 1 d U . .
C406 C 0.6655(5) 0.7017(3) 0.1748(2) 0.052(2) Uani 1 1 d . B .
H301 H 0.6314 0.6826 0.1642 0.063 Uiso 1 1 calc R . .
C407 C 0.6434(5) 0.7421(3) 0.1764(2) 0.050(2) Uani 1 1 d . . .
C408 C 0.6962(5) 0.7698(3) 0.1915(2) 0.056(2) Uani 1 1 d . B .
H302 H 0.6857 0.7988 0.1927 0.067 Uiso 1 1 calc R . .
C409 C 0.7629(4) 0.7548(3) 0.2043(2) 0.0416(15) Uani 1 1 d U . .
O41 O 0.8493(3) 0.70297(18) 0.21787(13) 0.0388(11) Uani 1 1 d U . .
C410 C 0.8156(6) 0.7849(3) 0.2200(2) 0.058(3) Uani 1 1 d . B .
H303 H 0.8597 0.7740 0.2307 0.070 Uiso 1 1 calc R . .
O42 O 0.8080(4) 0.8230(2) 0.22074(19) 0.071(2) Uani 1 1 d . . .
C411 C 0.5685(5) 0.7576(4) 0.1613(3) 0.069(3) Uani 1 1 d . B .
C412 C 0.5501(7) 0.8015(4) 0.1738(4) 0.088(4) Uani 1 1 d . . .
H304 H 0.5488 0.8011 0.1985 0.132 Uiso 1 1 calc R B .
H305 H 0.5022 0.8101 0.1634 0.132 Uiso 1 1 calc R . .
H306 H 0.5875 0.8212 0.1675 0.132 Uiso 1 1 calc R . .
C413 C 0.5711(6) 0.7589(5) 0.1240(3) 0.087(4) Uani 1 1 d . . .
H307 H 0.5834 0.7313 0.1157 0.131 Uiso 1 1 calc R B .
H308 H 0.6083 0.7790 0.1181 0.131 Uiso 1 1 calc R . .
H309 H 0.5232 0.7675 0.1135 0.131 Uiso 1 1 calc R . .
C414 C 0.5082(5) 0.7287(5) 0.1709(3) 0.090(4) Uani 1 1 d . . .
H310 H 0.5058 0.7291 0.1956 0.136 Uiso 1 1 calc R B .
H311 H 0.5185 0.7003 0.1636 0.136 Uiso 1 1 calc R . .
H312 H 0.4612 0.7380 0.1599 0.136 Uiso 1 1 calc R . .
Pd15 Pd 0.95895(3) 0.654775(19) 0.157522(13) 0.03218(12) Uani 1 1 d . . .
Pd16 Pd 0.91631(3) 0.661545(18) 0.056228(13) 0.03069(12) Uani 1 1 d . . .
C415 C 0.8524(4) 0.7146(2) 0.12990(17) 0.0318(15) Uani 1 1 d U . .
C416 C 0.8901(4) 0.7494(2) 0.14259(18) 0.0322(16) Uani 1 1 d . B .
C417 C 0.8688(5) 0.7885(3) 0.13228(17) 0.0409(19) Uani 1 1 d . . .
H313 H 0.8973 0.8114 0.1408 0.049 Uiso 1 1 calc R B .
C418 C 0.8071(5) 0.7969(3) 0.1097(2) 0.050(2) Uani 1 1 d . B .
C419 C 0.7681(5) 0.7619(3) 0.0979(2) 0.049(2) Uani 1 1 d . . .
H314 H 0.7249 0.7658 0.0834 0.058 Uiso 1 1 calc R B .
C420 C 0.7898(4) 0.7217(3) 0.10639(18) 0.0416(18) Uani 1 1 d . B .
O43 O 0.8643(3) 0.67494(16) 0.13493(14) 0.0389(13) Uani 1 1 d . B .
C421 C 0.7443(4) 0.6868(3) 0.0933(2) 0.047(2) Uani 1 1 d . . .
H315 H 0.7604 0.6594 0.0991 0.057 Uiso 1 1 calc R B .
O44 O 0.6878(4) 0.6903(2) 0.07575(18) 0.071(2) Uani 1 1 d . B .
C422 C 0.7828(6) 0.8414(3) 0.1023(3) 0.060(3) Uani 1 1 d . . .
C423 C 0.7278(8) 0.8432(4) 0.0701(3) 0.089(4) Uani 1 1 d . B .
H316 H 0.7518 0.8330 0.0505 0.133 Uiso 1 1 calc R . .
H317 H 0.7119 0.8720 0.0661 0.133 Uiso 1 1 calc R . .
H318 H 0.6852 0.8257 0.0737 0.133 Uiso 1 1 calc R . .
C424 C 0.7489(8) 0.8588(4) 0.1325(3) 0.085(4) Uani 1 1 d . B .
H319 H 0.7076 0.8413 0.1378 0.127 Uiso 1 1 calc R . .
H320 H 0.7315 0.8872 0.1274 0.127 Uiso 1 1 calc R . .
H321 H 0.7855 0.8594 0.1519 0.127 Uiso 1 1 calc R . .
C425 C 0.8480(7) 0.8687(3) 0.0937(3) 0.080(4) Uani 1 1 d . B .
H322 H 0.8706 0.8569 0.0743 0.120 Uiso 1 1 calc R . .
H323 H 0.8842 0.8697 0.1133 0.120 Uiso 1 1 calc R . .
H324 H 0.8307 0.8970 0.0882 0.120 Uiso 1 1 calc R . .
N29 N 0.9888(3) 0.7101(2) 0.17579(15) 0.0395(16) Uani 1 1 d . B .
C426 C 0.9535(4) 0.7466(3) 0.16944(18) 0.0372(17) Uani 1 1 d . . .
C427 C 0.9764(5) 0.7817(3) 0.1885(2) 0.050(2) Uani 1 1 d . B .
H325 H 0.9507 0.8074 0.1855 0.060 Uiso 1 1 calc R . .
C428 C 1.0366(5) 0.7788(3) 0.2118(2) 0.056(2) Uani 1 1 d . . .
H326 H 1.0532 0.8027 0.2242 0.067 Uiso 1 1 calc R B .
C429 C 1.0728(5) 0.7414(3) 0.2170(2) 0.052(2) Uani 1 1 d . B .
H327 H 1.1152 0.7397 0.2324 0.063 Uiso 1 1 calc R . .
C430 C 1.0472(4) 0.7069(3) 0.2001(2) 0.046(2) Uani 1 1 d . . .
N30 N 1.0493(3) 0.6353(2) 0.18194(14) 0.0350(14) Uani 1 1 d . B .
C431 C 1.0789(4) 0.6657(3) 0.2043(2) 0.048(2) Uani 1 1 d . B .
C432 C 1.1338(5) 0.6539(4) 0.2283(2) 0.057(2) Uani 1 1 d . . .
H328 H 1.1544 0.6738 0.2440 0.069 Uiso 1 1 calc R B .
C433 C 1.1584(5) 0.6145(4) 0.2296(3) 0.067(3) Uani 1 1 d . B .
H329 H 1.1962 0.6068 0.2462 0.080 Uiso 1 1 calc R . .
C434 C 1.1297(5) 0.5853(3) 0.2072(2) 0.051(2) Uani 1 1 d . . .
H330 H 1.1466 0.5573 0.2085 0.061 Uiso 1 1 calc R B .
C435 C 1.0766(4) 0.5966(3) 0.1828(2) 0.046(2) Uani 1 1 d . B .
C436 C 0.9588(4) 0.5388(2) 0.1126(2) 0.0394(18) Uani 1 1 d . B .
C437 C 0.9782(4) 0.5693(3) 0.1368(2) 0.0415(18) Uani 1 1 d . . .
C438 C 1.0488(5) 0.5666(3) 0.1560(2) 0.0434(19) Uani 1 1 d . B .
C439 C 1.0964(5) 0.5354(3) 0.1478(2) 0.050(2) Uani 1 1 d . . .
H331 H 1.1440 0.5347 0.1591 0.060 Uiso 1 1 calc R B .
C440 C 1.0771(5) 0.5049(3) 0.1235(2) 0.049(2) Uani 1 1 d . B .
C441 C 1.1259(6) 0.4721(4) 0.1148(3) 0.064(3) Uani 1 1 d . . .
H332 H 1.1731 0.4703 0.1265 0.076 Uiso 1 1 calc R B .
C442 C 1.1073(7) 0.4449(4) 0.0911(3) 0.071(3) Uani 1 1 d . B .
H333 H 1.1422 0.4248 0.0853 0.086 Uiso 1 1 calc R . .
C443 C 1.0376(6) 0.4443(3) 0.0741(3) 0.058(2) Uani 1 1 d . . .
H334 H 1.0245 0.4232 0.0580 0.069 Uiso 1 1 calc R B .
C444 C 0.9881(6) 0.4750(3) 0.0812(2) 0.052(2) Uani 1 1 d . B .
H335 H 0.9408 0.4752 0.0695 0.062 Uiso 1 1 calc R . .
C445 C 1.0076(5) 0.5065(3) 0.10613(19) 0.044(2) Uani 1 1 d . . .
O45 O 0.9300(3) 0.59821(16) 0.14337(13) 0.0354(12) Uani 1 1 d . B .
C446 C 0.8860(4) 0.5432(2) 0.0932(2) 0.0390(17) Uani 1 1 d . . .
C447 C 0.8755(4) 0.5771(2) 0.07066(19) 0.0369(17) Uani 1 1 d . B .
C448 C 0.8057(5) 0.5820(2) 0.0525(2) 0.0403(18) Uani 1 1 d . . .
C449 C 0.7477(5) 0.5546(3) 0.0585(2) 0.049(2) Uani 1 1 d . B .
H336 H 0.7013 0.5583 0.0464 0.059 Uiso 1 1 calc R . .
C450 C 0.7577(5) 0.5222(3) 0.0819(2) 0.046(2) Uani 1 1 d . . .
C451 C 0.6972(5) 0.4966(3) 0.0893(3) 0.058(2) Uani 1 1 d . B .
H337 H 0.6503 0.5012 0.0779 0.070 Uiso 1 1 calc R . .
C452 C 0.7067(6) 0.4658(3) 0.1127(3) 0.067(3) Uani 1 1 d . . .
H338 H 0.6659 0.4501 0.1189 0.080 Uiso 1 1 calc R B .
C453 C 0.7761(6) 0.4573(3) 0.1274(3) 0.063(3) Uani 1 1 d . B .
H339 H 0.7823 0.4340 0.1423 0.076 Uiso 1 1 calc R . .
C454 C 0.8366(5) 0.4810(3) 0.1215(3) 0.054(2) Uani 1 1 d . . .
H340 H 0.8832 0.4748 0.1326 0.064 Uiso 1 1 calc R B .
C455 C 0.8274(5) 0.5153(2) 0.0982(2) 0.0431(19) Uani 1 1 d . B .
O46 O 0.9321(3) 0.60176(17) 0.06691(13) 0.0397(13) Uani 1 1 d . . .
N31 N 0.8238(3) 0.6503(2) 0.02935(14) 0.0343(14) Uani 1 1 d . . .
C456 C 0.7883(4) 0.6138(3) 0.02674(19) 0.0403(18) Uani 1 1 d . B .
C457 C 0.7334(5) 0.6079(3) 0.0002(2) 0.049(2) Uani 1 1 d . . .
H341 H 0.7100 0.5816 -0.0028 0.058 Uiso 1 1 calc R B .
C458 C 0.7139(5) 0.6398(3) -0.0212(2) 0.059(3) Uani 1 1 d . B .
H342 H 0.6790 0.6356 -0.0400 0.070 Uiso 1 1 calc R . .
C459 C 0.7446(5) 0.6776(3) -0.0156(2) 0.058(3) Uani 1 1 d . . .
H343 H 0.7270 0.7006 -0.0288 0.070 Uiso 1 1 calc R B .
C460 C 0.8017(4) 0.6834(3) 0.00926(19) 0.0401(18) Uani 1 1 d . B .
N32 N 0.8989(3) 0.7196(2) 0.04070(13) 0.0331(13) Uani 1 1 d . . .
C461 C 0.8421(4) 0.7225(3) 0.01623(15) 0.0333(15) Uani 1 1 d . B .
C462 C 0.8258(4) 0.7590(3) -0.00007(19) 0.046(2) Uani 1 1 d . . .
H344 H 0.7852 0.7607 -0.0165 0.055 Uiso 1 1 calc R B .
C463 C 0.8684(5) 0.7934(3) 0.00744(19) 0.044(2) Uani 1 1 d . B .
H345 H 0.8588 0.8188 -0.0044 0.053 Uiso 1 1 calc R . .
C464 C 0.9254(5) 0.7909(3) 0.03226(19) 0.0415(18) Uani 1 1 d . . .
H346 H 0.9545 0.8149 0.0375 0.050 Uiso 1 1 calc R B .
C465 C 0.9422(4) 0.7526(2) 0.0506(2) 0.0358(17) Uani 1 1 d . B .
C466 C 1.0349(4) 0.7116(2) 0.08921(18) 0.0351(17) Uani 1 1 d . B .
C467 C 1.0011(4) 0.7503(3) 0.0759(2) 0.0367(17) Uani 1 1 d . . .
C468 C 1.0331(5) 0.7864(3) 0.0905(2) 0.050(2) Uani 1 1 d . B .
H347 H 1.0098 0.8119 0.0838 0.059 Uiso 1 1 calc R . .
C469 C 1.0921(5) 0.7901(3) 0.1128(2) 0.047(2) Uani 1 1 d . . .
C470 C 1.1247(4) 0.7529(3) 0.1236(2) 0.0435(19) Uani 1 1 d . B .
H348 H 1.1671 0.7537 0.1391 0.052 Uiso 1 1 calc R . .
C471 C 1.0972(4) 0.7144(3) 0.11256(17) 0.0391(18) Uani 1 1 d . . .
O47 O 1.0136(3) 0.67311(16) 0.08069(12) 0.0336(11) Uani 1 1 d . . .
C472 C 1.1316(4) 0.6763(3) 0.12422(19) 0.0393(18) Uani 1 1 d . B .
H349 H 1.1095 0.6508 0.1169 0.047 Uiso 1 1 calc R . .
O48 O 1.1885(3) 0.6748(2) 0.14322(16) 0.0577(17) Uani 1 1 d . . .
C473 C 1.1229(6) 0.8317(3) 0.1243(2) 0.057(2) Uani 1 1 d . B .
C474 C 1.1783(7) 0.8296(4) 0.1539(3) 0.075(3) Uani 1 1 d . . .
H350 H 1.1956 0.8577 0.1598 0.113 Uiso 1 1 calc R B .
H351 H 1.2197 0.8124 0.1480 0.113 Uiso 1 1 calc R . .
H352 H 1.1560 0.8172 0.1732 0.113 Uiso 1 1 calc R . .
C475 C 1.1589(6) 0.8524(3) 0.0941(3) 0.063(3) Uani 1 1 d . . .
H353 H 1.1795 0.8795 0.1012 0.094 Uiso 1 1 calc R B .
H354 H 1.1218 0.8564 0.0752 0.094 Uiso 1 1 calc R . .
H355 H 1.1979 0.8344 0.0869 0.094 Uiso 1 1 calc R . .
C476 C 1.0621(7) 0.8609(3) 0.1343(3) 0.070(3) Uani 1 1 d . . .
H356 H 1.0835 0.8877 0.1417 0.104 Uiso 1 1 calc R B .
H357 H 1.0371 0.8484 0.1528 0.104 Uiso 1 1 calc R . .
H358 H 1.0269 0.8653 0.1147 0.104 Uiso 1 1 calc R . .
O49 O 0.9482(8) 0.9742(5) 0.6559(4) 0.177(5) Uani 1 1 d DU . .
C477 C 0.9940(11) 0.9593(6) 0.6787(5) 0.125(4) Uani 1 1 d U . .
H359 H 0.9757 0.9464 0.6979 0.150 Uiso 1 1 calc R . .
N33 N 1.0685(8) 0.9610(4) 0.6766(3) 0.108(3) Uani 1 1 d U . .
C478 C 1.1021(10) 0.9839(6) 0.6533(4) 0.126(4) Uani 1 1 d U . .
H360 H 1.1553 0.9800 0.6568 0.190 Uiso 1 1 calc R . .
H361 H 1.0903 1.0134 0.6559 0.190 Uiso 1 1 calc R . .
H362 H 1.0851 0.9746 0.6304 0.190 Uiso 1 1 calc R . .
C479 C 1.1160(9) 0.9417(5) 0.7026(4) 0.107(4) Uani 1 1 d U . .
H363 H 1.1671 0.9471 0.6984 0.161 Uiso 1 1 calc R . .
H364 H 1.1072 0.9116 0.7025 0.161 Uiso 1 1 calc R . .
H365 H 1.1061 0.9532 0.7247 0.161 Uiso 1 1 calc R . .
O50 O 0.6270(5) 1.2773(4) 0.7489(3) 0.112(4) Uani 1 1 d . . .
C480 C 0.6264(5) 1.2384(5) 0.7500(3) 0.077(4) Uani 1 1 d . . .
H366 H 0.5993 1.2237 0.7324 0.092 Uiso 1 1 calc R . .
N34 N 0.6612(4) 1.2171(3) 0.7741(2) 0.068(2) Uani 1 1 d . . .
C481 C 0.7043(7) 1.2375(5) 0.8007(3) 0.097(5) Uani 1 1 d . . .
H367 H 0.7262 1.2167 0.8165 0.145 Uiso 1 1 calc R . .
H368 H 0.6731 1.2563 0.8128 0.145 Uiso 1 1 calc R . .
H369 H 0.7431 1.2536 0.7911 0.145 Uiso 1 1 calc R . .
C482 C 0.6529(9) 1.1731(5) 0.7744(6) 0.136(7) Uani 1 1 d . . .
H370 H 0.6821 1.1615 0.7940 0.204 Uiso 1 1 calc R . .
H371 H 0.6696 1.1614 0.7535 0.204 Uiso 1 1 calc R . .
H372 H 0.6012 1.1661 0.7760 0.204 Uiso 1 1 calc R . .
O51 O 0.7634(5) 0.8141(3) 0.7618(2) 0.105(3) Uani 1 1 d D . .
C483 C 0.7821(8) 0.8440(5) 0.7796(4) 0.099(5) Uani 1 1 d . . .
H373 H 0.7934 0.8692 0.7685 0.118 Uiso 1 1 calc R . .
N35 N 0.7880(7) 0.8437(4) 0.8140(3) 0.108(4) Uani 1 1 d . . .
C484 C 0.7657(8) 0.8097(5) 0.8316(4) 0.104(5) Uani 1 1 d . . .
H374 H 0.7738 0.8150 0.8560 0.156 Uiso 1 1 calc R . .
H375 H 0.7938 0.7852 0.8257 0.156 Uiso 1 1 calc R . .
H376 H 0.7135 0.8047 0.8257 0.156 Uiso 1 1 calc R . .
C485 C 0.8238(13) 0.8807(6) 0.8315(5) 0.159(9) Uani 1 1 d . . .
H377 H 0.8248 0.8769 0.8560 0.238 Uiso 1 1 calc R . .
H378 H 0.7961 0.9059 0.8249 0.238 Uiso 1 1 calc R . .
H379 H 0.8740 0.8834 0.8248 0.238 Uiso 1 1 calc R . .
O52 O 0.5925(10) 0.5393(6) 0.9639(4) 0.197(5) Uani 1 1 d DU . .
C486 C 0.5761(11) 0.5586(7) 0.9370(6) 0.133(4) Uani 1 1 d U . .
H380 H 0.5339 0.5759 0.9356 0.160 Uiso 1 1 calc R . .
N36 N 0.6148(9) 0.5560(5) 0.9107(5) 0.134(3) Uani 1 1 d U . .
C487 C 0.6844(12) 0.5345(8) 0.9112(8) 0.204(7) Uani 1 1 d U . .
H381 H 0.7057 0.5385 0.8895 0.306 Uiso 1 1 calc R . .
H382 H 0.6768 0.5047 0.9150 0.306 Uiso 1 1 calc R . .
H383 H 0.7178 0.5457 0.9296 0.306 Uiso 1 1 calc R . .
C488 C 0.5994(14) 0.5767(9) 0.8846(6) 0.200(8) Uani 1 1 d U . .
H384 H 0.6340 0.5700 0.8677 0.300 Uiso 1 1 calc R . .
H385 H 0.6025 0.6065 0.8900 0.300 Uiso 1 1 calc R . .
H386 H 0.5496 0.5699 0.8754 0.300 Uiso 1 1 calc R . .
O53 O -0.0549(9) 0.8841(5) 0.4752(4) 0.182(5) Uani 1 1 d DU . .
C489 C -0.0235(12) 0.8519(7) 0.4885(6) 0.146(4) Uani 1 1 d U . .
H387 H 0.0273 0.8492 0.4857 0.175 Uiso 1 1 calc R . .
N37 N -0.0522(9) 0.8226(6) 0.5054(5) 0.148(4) Uani 1 1 d U . .
C490 C -0.1300(11) 0.8241(7) 0.5096(5) 0.150(5) Uani 1 1 d U . .
H388 H -0.1438 0.8000 0.5229 0.225 Uiso 1 1 calc R . .
H389 H -0.1573 0.8235 0.4873 0.225 Uiso 1 1 calc R . .
H390 H -0.1415 0.8497 0.5215 0.225 Uiso 1 1 calc R . .
C491 C 0.0035(14) 0.7823(8) 0.5217(7) 0.204(8) Uani 1 1 d U . .
H391 H -0.0259 0.7625 0.5338 0.306 Uiso 1 1 calc R . .
H392 H 0.0425 0.7937 0.5374 0.306 Uiso 1 1 calc R . .
H393 H 0.0252 0.7679 0.5031 0.306 Uiso 1 1 calc R . .
O54 O 0.1327(8) 0.8168(4) 0.4511(3) 0.142(4) Uani 1 1 d DU . .
C492 C 0.1231(11) 0.8445(6) 0.4259(5) 0.136(5) Uani 1 1 d U . .
H394 H 0.1155 0.8726 0.4323 0.164 Uiso 1 1 calc R . .
N38 N 0.1229(10) 0.8370(6) 0.3933(5) 0.154(4) Uani 1 1 d U . .
C493 C 0.1480(10) 0.7897(6) 0.3834(4) 0.133(5) Uani 1 1 d U . .
H395 H 0.1463 0.7869 0.3587 0.200 Uiso 1 1 calc R . .
H396 H 0.1147 0.7694 0.3925 0.200 Uiso 1 1 calc R . .
H397 H 0.1980 0.7845 0.3931 0.200 Uiso 1 1 calc R . .
C494 C 0.1101(17) 0.8677(8) 0.3702(6) 0.204(7) Uani 1 1 d U . .
H398 H 0.1121 0.8562 0.3474 0.306 Uiso 1 1 calc R . .
H399 H 0.1475 0.8894 0.3740 0.306 Uiso 1 1 calc R . .
H400 H 0.0616 0.8797 0.3725 0.306 Uiso 1 1 calc R . .
O55 O 0.8432(13) 0.9174(8) 0.5757(6) 0.280(6) Uani 1 1 d DU . .
C495 C 0.8433(12) 0.9347(8) 0.5415(7) 0.174(3) Uani 1 1 d U . .
H401 H 0.8183 0.9223 0.5222 0.209 Uiso 1 1 calc R . .
N39 N 0.8874(11) 0.9744(6) 0.5402(6) 0.173(3) Uani 1 1 d U . .
C496 C 0.9403(13) 0.9897(8) 0.5620(6) 0.181(6) Uani 1 1 d U . .
H402 H 0.9576 1.0163 0.5535 0.271 Uiso 1 1 calc R . .
H403 H 0.9811 0.9699 0.5644 0.271 Uiso 1 1 calc R . .
H404 H 0.9209 0.9940 0.5841 0.271 Uiso 1 1 calc R . .
C497 C 0.8685(15) 0.9992(8) 0.5055(6) 0.192(7) Uani 1 1 d U . .
H405 H 0.8988 1.0243 0.5053 0.288 Uiso 1 1 calc R . .
H406 H 0.8167 1.0071 0.5037 0.288 Uiso 1 1 calc R . .
H407 H 0.8786 0.9814 0.4864 0.288 Uiso 1 1 calc R . .
O56 O 0.5573(10) 0.4391(7) 0.5482(5) 0.117(4) Uiso 0.50 1 d PD C 1
C498 C 0.5902(11) 0.4553(8) 0.5317(4) 0.117(4) Uiso 0.50 1 d PD C 1
H408 H 0.5900 0.4844 0.5363 0.140 Uiso 0.50 1 calc PR C 1
N40 N 0.6336(11) 0.4465(7) 0.5053(5) 0.117(4) Uiso 0.50 1 d PD C 1
C499 C 0.6708(16) 0.4051(7) 0.5090(7) 0.117(4) Uiso 0.50 1 d PD C 1
H409 H 0.6990 0.4001 0.4893 0.175 Uiso 0.50 1 calc PR C 1
H410 H 0.6340 0.3831 0.5103 0.175 Uiso 0.50 1 calc PR C 1
H411 H 0.7039 0.4049 0.5296 0.175 Uiso 0.50 1 calc PR C 1
C500 C 0.6660(17) 0.4702(8) 0.4794(7) 0.117(4) Uiso 0.50 1 d PD C 1
H412 H 0.6884 0.4512 0.4638 0.175 Uiso 0.50 1 calc PR C 1
H413 H 0.7035 0.4888 0.4900 0.175 Uiso 0.50 1 calc PR C 1
H414 H 0.6280 0.4868 0.4668 0.175 Uiso 0.50 1 calc PR C 1
O57 O 0.5838(13) 0.4262(10) 0.6227(7) 0.197(9) Uiso 0.50 1 d PD D 2
C501 C 0.6272(13) 0.4340(10) 0.5966(6) 0.197(9) Uiso 0.50 1 d PD D 2
H415 H 0.6168 0.4464 0.5750 0.237 Uiso 0.50 1 calc PR D 2
N41 N 0.6949(11) 0.4166(8) 0.6132(6) 0.197(9) Uiso 0.50 1 d PD D 2
C502 C 0.7627(13) 0.4180(13) 0.5993(9) 0.197(9) Uiso 0.50 1 d PD D 2
H416 H 0.8000 0.4050 0.6149 0.296 Uiso 0.50 1 calc PR D 2
H417 H 0.7762 0.4471 0.5955 0.296 Uiso 0.50 1 calc PR D 2
H418 H 0.7595 0.4030 0.5777 0.296 Uiso 0.50 1 calc PR D 2
C503 C 0.688(2) 0.3966(13) 0.6460(8) 0.197(9) Uiso 0.50 1 d PD D 2
H419 H 0.7360 0.3864 0.6551 0.296 Uiso 0.50 1 calc PR D 2
H420 H 0.6538 0.3732 0.6432 0.296 Uiso 0.50 1 calc PR D 2
H421 H 0.6696 0.4169 0.6618 0.296 Uiso 0.50 1 calc PR D 2
O58 O 0.7294(11) 0.5199(7) 0.6457(5) 0.131(5) Uiso 0.50 1 d PD . .
C504 C 0.7776(13) 0.4995(8) 0.6586(5) 0.131(5) Uiso 0.50 1 d PD . .
H422 H 0.8064 0.4850 0.6436 0.158 Uiso 0.50 1 calc PR . .
N42 N 0.7969(12) 0.4943(7) 0.6917(5) 0.131(5) Uiso 0.50 1 d PD . .
C505 C 0.7616(16) 0.5142(10) 0.7187(6) 0.131(5) Uiso 0.50 1 d PD . .
H423 H 0.7867 0.5064 0.7405 0.197 Uiso 0.50 1 calc PR . .
H424 H 0.7104 0.5053 0.7180 0.197 Uiso 0.50 1 calc PR . .
H425 H 0.7637 0.5445 0.7159 0.197 Uiso 0.50 1 calc PR . .
C506 C 0.8544(15) 0.4643(9) 0.7048(7) 0.131(5) Uiso 0.50 1 d PD . .
H426 H 0.8584 0.4648 0.7296 0.197 Uiso 0.50 1 calc PR . .
H427 H 0.9015 0.4721 0.6965 0.197 Uiso 0.50 1 calc PR . .
H428 H 0.8411 0.4361 0.6969 0.197 Uiso 0.50 1 calc PR . .
O59 O 0.6851(8) 0.9581(6) 0.8408(4) 0.092(3) Uiso 0.50 1 d PD . .
C507 C 0.6265(9) 0.9679(6) 0.8496(5) 0.092(3) Uiso 0.50 1 d PD . .
H429 H 0.6142 0.9966 0.8470 0.110 Uiso 0.50 1 calc PR . .
N43 N 0.5745(8) 0.9431(5) 0.8628(5) 0.092(3) Uiso 0.50 1 d PD . .
C508 C 0.5819(13) 0.8977(5) 0.8642(7) 0.092(3) Uiso 0.50 1 d PD . .
H430 H 0.5398 0.8857 0.8745 0.138 Uiso 0.50 1 calc PR . .
H431 H 0.6270 0.8903 0.8778 0.138 Uiso 0.50 1 calc PR . .
H432 H 0.5838 0.8868 0.8412 0.138 Uiso 0.50 1 calc PR . .
C509 C 0.5026(9) 0.9599(7) 0.8678(7) 0.092(3) Uiso 0.50 1 d PD . .
H433 H 0.4726 0.9384 0.8775 0.138 Uiso 0.50 1 calc PR . .
H434 H 0.4790 0.9689 0.8459 0.138 Uiso 0.50 1 calc PR . .
H435 H 0.5076 0.9837 0.8832 0.138 Uiso 0.50 1 calc PR . .
O60 O 0.4610(8) 0.4512(6) 1.0274(5) 0.104(4) Uiso 0.50 1 d PD E 1
C510 C 0.4168(9) 0.4564(7) 1.0495(5) 0.104(4) Uiso 0.50 1 d PD E 1
H436 H 0.4292 0.4739 1.0684 0.125 Uiso 0.50 1 calc PR E 1
N44 N 0.3491(9) 0.4364(6) 1.0461(5) 0.104(4) Uiso 0.50 1 d PD E 1
C511 C 0.3288(14) 0.4079(8) 1.0187(6) 0.104(4) Uiso 0.50 1 d PD E 1
H437 H 0.2795 0.3971 1.0211 0.156 Uiso 0.50 1 calc PR E 1
H438 H 0.3637 0.3847 1.0192 0.156 Uiso 0.50 1 calc PR E 1
H439 H 0.3295 0.4226 0.9970 0.156 Uiso 0.50 1 calc PR E 1
C512 C 0.2955(12) 0.4450(9) 1.0705(6) 0.104(4) Uiso 0.50 1 d PD E 1
H440 H 0.2514 0.4283 1.0649 0.156 Uiso 0.50 1 calc PR E 1
H441 H 0.2827 0.4747 1.0696 0.156 Uiso 0.50 1 calc PR E 1
H442 H 0.3162 0.4379 1.0933 0.156 Uiso 0.50 1 calc PR E 1
O61 O 0.4517(18) 0.4142(13) 0.9761(8) 0.278(14) Uiso 0.50 1 d PD F 2
C513 C 0.5048(18) 0.4245(11) 0.9609(7) 0.278(14) Uiso 0.50 1 d PD F 2
H443 H 0.5383 0.4444 0.9709 0.334 Uiso 0.50 1 calc PR F 2
N45 N 0.5170(16) 0.4083(10) 0.9301(7) 0.278(14) Uiso 0.50 1 d PD F 2
C514 C 0.468(2) 0.3780(15) 0.9132(11) 0.278(14) Uiso 0.50 1 d PD F 2
H444 H 0.4855 0.3706 0.8913 0.417 Uiso 0.50 1 calc PR F 2
H445 H 0.4186 0.3901 0.9096 0.417 Uiso 0.50 1 calc PR F 2
H446 H 0.4658 0.3530 0.9273 0.417 Uiso 0.50 1 calc PR F 2
C515 C 0.577(2) 0.4213(17) 0.9098(11) 0.278(14) Uiso 0.50 1 d PD F 2
H447 H 0.5738 0.4056 0.8885 0.417 Uiso 0.50 1 calc PR F 2
H448 H 0.6238 0.4157 0.9224 0.417 Uiso 0.50 1 calc PR F 2
H449 H 0.5724 0.4511 0.9049 0.417 Uiso 0.50 1 calc PR F 2
O62 O 0.5287(14) 0.9307(9) 0.7899(5) 0.135(6) Uiso 0.50 1 d PD G 1
C516 C 0.5768(14) 0.9370(8) 0.7711(5) 0.135(6) Uiso 0.50 1 d PD G 1
H450 H 0.6203 0.9503 0.7802 0.162 Uiso 0.50 1 calc PR G 1
N46 N 0.5725(12) 0.9263(8) 0.7374(5) 0.135(6) Uiso 0.50 1 d PD G 1
C517 C 0.5053(13) 0.9070(11) 0.7222(7) 0.135(6) Uiso 0.50 1 d PD G 1
H451 H 0.5102 0.9019 0.6981 0.203 Uiso 0.50 1 calc PR G 1
H452 H 0.4637 0.9256 0.7248 0.203 Uiso 0.50 1 calc PR G 1
H453 H 0.4970 0.8805 0.7336 0.203 Uiso 0.50 1 calc PR G 1
C518 C 0.6325(14) 0.9314(11) 0.7160(7) 0.135(6) Uiso 0.50 1 d PD G 1
H454 H 0.6166 0.9228 0.6929 0.203 Uiso 0.50 1 calc PR G 1
H455 H 0.6738 0.9140 0.7247 0.203 Uiso 0.50 1 calc PR G 1
H456 H 0.6476 0.9607 0.7161 0.203 Uiso 0.50 1 calc PR G 1
O63 O 0.5108(15) 0.9213(9) 0.7920(6) 0.140(6) Uiso 0.50 1 d PD H 2
C519 C 0.5155(12) 0.9269(8) 0.7619(6) 0.140(6) Uiso 0.50 1 d PD H 2
H457 H 0.4724 0.9356 0.7489 0.168 Uiso 0.50 1 calc PR H 2
N47 N 0.5773(12) 0.9218(9) 0.7449(5) 0.140(6) Uiso 0.50 1 d PD H 2
C520 C 0.6465(13) 0.9063(12) 0.7630(7) 0.140(6) Uiso 0.50 1 d PD H 2
H458 H 0.6848 0.9048 0.7471 0.209 Uiso 0.50 1 calc PR H 2
H459 H 0.6383 0.8784 0.7721 0.209 Uiso 0.50 1 calc PR H 2
H460 H 0.6617 0.9253 0.7815 0.209 Uiso 0.50 1 calc PR H 2
C521 C 0.5773(17) 0.9244(12) 0.7087(5) 0.140(6) Uiso 0.50 1 d PD H 2
H461 H 0.6273 0.9205 0.7021 0.209 Uiso 0.50 1 calc PR H 2
H462 H 0.5592 0.9518 0.7011 0.209 Uiso 0.50 1 calc PR H 2
H463 H 0.5455 0.9026 0.6983 0.209 Uiso 0.50 1 calc PR H 2
O64 O 0.7065(11) 1.0415(6) 0.7444(4) 0.094(3) Uiso 0.50 1 d PD I 1
C522 C 0.7184(11) 1.0309(6) 0.7158(4) 0.094(3) Uiso 0.50 1 d PD I 1
H464 H 0.7337 1.0031 0.7123 0.113 Uiso 0.50 1 calc PR I 1
N48 N 0.7109(12) 1.0571(6) 0.6884(4) 0.094(3) Uiso 0.50 1 d PD I 1
C523 C 0.6882(15) 1.1003(5) 0.6913(6) 0.094(3) Uiso 0.50 1 d PD I 1
H465 H 0.6858 1.1134 0.6689 0.141 Uiso 0.50 1 calc PR I 1
H466 H 0.7237 1.1152 0.7066 0.141 Uiso 0.50 1 calc PR I 1
H467 H 0.6398 1.1014 0.7002 0.141 Uiso 0.50 1 calc PR I 1
C524 C 0.7219(15) 1.0422(7) 0.6545(4) 0.094(3) Uiso 0.50 1 d PD I 1
H468 H 0.7133 1.0650 0.6382 0.141 Uiso 0.50 1 calc PR I 1
H469 H 0.6876 1.0195 0.6485 0.141 Uiso 0.50 1 calc PR I 1
H470 H 0.7722 1.0321 0.6538 0.141 Uiso 0.50 1 calc PR I 1
O65 O 0.6960(11) 1.0566(6) 0.7472(4) 0.096(4) Uiso 0.50 1 d PD J 2
C525 C 0.6817(11) 1.0714(7) 0.7197(4) 0.096(4) Uiso 0.50 1 d PD J 2
H471 H 0.6416 1.0902 0.7174 0.115 Uiso 0.50 1 calc PR J 2
N49 N 0.7176(11) 1.0640(6) 0.6914(4) 0.096(4) Uiso 0.50 1 d PD J 2
C526 C 0.7761(12) 1.0326(7) 0.6908(6) 0.096(4) Uiso 0.50 1 d PD J 2
H472 H 0.7948 1.0321 0.6683 0.144 Uiso 0.50 1 calc PR J 2
H473 H 0.7564 1.0051 0.6959 0.144 Uiso 0.50 1 calc PR J 2
H474 H 0.8159 1.0396 0.7078 0.144 Uiso 0.50 1 calc PR J 2
C527 C 0.7038(14) 1.0874(8) 0.6602(5) 0.096(4) Uiso 0.50 1 d PD J 2
H475 H 0.7352 1.0769 0.6432 0.144 Uiso 0.50 1 calc PR J 2
H476 H 0.7146 1.1169 0.6645 0.144 Uiso 0.50 1 calc PR J 2
H477 H 0.6523 1.0843 0.6518 0.144 Uiso 0.50 1 calc PR J 2
O66 O 0.6062(11) 1.0426(5) 0.8881(5) 0.115(4) Uiso 0.50 1 d PD K 1
C528 C 0.6056(11) 1.0795(6) 0.8856(6) 0.115(4) Uiso 0.50 1 d PD K 1
H478 H 0.5690 1.0945 0.8962 0.138 Uiso 0.50 1 calc PR K 1
N50 N 0.6550(11) 1.1015(5) 0.8683(5) 0.115(4) Uiso 0.50 1 d PD K 1
C529 C 0.7051(14) 1.0839(8) 0.8475(7) 0.115(4) Uiso 0.50 1 d PD K 1
H479 H 0.7334 1.1060 0.8376 0.173 Uiso 0.50 1 calc PR K 1
H480 H 0.6786 1.0680 0.8293 0.173 Uiso 0.50 1 calc PR K 1
H481 H 0.7383 1.0653 0.8609 0.173 Uiso 0.50 1 calc PR K 1
C530 C 0.6461(15) 1.1474(5) 0.8671(7) 0.115(4) Uiso 0.50 1 d PD K 1
H482 H 0.6836 1.1595 0.8537 0.173 Uiso 0.50 1 calc PR K 1
H483 H 0.6515 1.1586 0.8902 0.173 Uiso 0.50 1 calc PR K 1
H484 H 0.5974 1.1543 0.8566 0.173 Uiso 0.50 1 calc PR K 1
O67 O 0.6198(12) 1.1231(10) 0.8854(7) 0.173(7) Uiso 0.50 1 d PD L 2
C531 C 0.5687(11) 1.1039(10) 0.8931(7) 0.173(7) Uiso 0.50 1 d PD L 2
H485 H 0.5838 1.0756 0.8940 0.208 Uiso 0.50 1 calc PR L 2
N51 N 0.5007(12) 1.1040(8) 0.9010(8) 0.173(7) Uiso 0.50 1 d PD L 2
C532 C 0.4515(17) 1.1403(8) 0.9021(11) 0.173(7) Uiso 0.50 1 d PD L 2
H486 H 0.4039 1.1312 0.9091 0.259 Uiso 0.50 1 calc PR L 2
H487 H 0.4450 1.1529 0.8795 0.259 Uiso 0.50 1 calc PR L 2
H488 H 0.4730 1.1607 0.9183 0.259 Uiso 0.50 1 calc PR L 2
C533 C 0.4632(18) 1.0658(9) 0.9127(11) 0.173(7) Uiso 0.50 1 d PD L 2
H489 H 0.4129 1.0727 0.9173 0.259 Uiso 0.50 1 calc PR L 2
H490 H 0.4897 1.0552 0.9334 0.259 Uiso 0.50 1 calc PR L 2
H491 H 0.4626 1.0444 0.8950 0.259 Uiso 0.50 1 calc PR L 2
O68 O 0.1377(9) 0.3941(5) 1.0168(4) 0.081(3) Uiso 0.50 1 d PD M 1
C534 C 0.0800(10) 0.3955(6) 0.9985(4) 0.081(3) Uiso 0.50 1 d PD M 1
H492 H 0.0451 0.3739 1.0001 0.098 Uiso 0.50 1 calc PR M 1
N52 N 0.0646(9) 0.4273(6) 0.9758(5) 0.081(3) Uiso 0.50 1 d PD M 1
C535 C 0.1159(11) 0.4613(6) 0.9735(7) 0.081(3) Uiso 0.50 1 d PD M 1
H493 H 0.0966 0.4812 0.9563 0.122 Uiso 0.50 1 calc PR M 1
H494 H 0.1629 0.4504 0.9673 0.122 Uiso 0.50 1 calc PR M 1
H495 H 0.1229 0.4754 0.9955 0.122 Uiso 0.50 1 calc PR M 1
C536 C -0.0020(10) 0.4282(7) 0.9534(6) 0.081(3) Uiso 0.50 1 d PD M 1
H496 H -0.0026 0.4534 0.9394 0.122 Uiso 0.50 1 calc PR M 1
H497 H -0.0445 0.4283 0.9670 0.122 Uiso 0.50 1 calc PR M 1
H498 H -0.0039 0.4036 0.9388 0.122 Uiso 0.50 1 calc PR M 1
O69 O 0.0886(11) 0.3867(6) 1.0155(4) 0.101(4) Uiso 0.50 1 d PD N 2
C537 C 0.0379(12) 0.3957(6) 0.9923(5) 0.101(4) Uiso 0.50 1 d PD N 2
H499 H -0.0077 0.3816 0.9893 0.121 Uiso 0.50 1 calc PR N 2
N53 N 0.0582(11) 0.4289(6) 0.9720(5) 0.101(4) Uiso 0.50 1 d PD N 2
C538 C 0.1302(11) 0.4479(9) 0.9814(7) 0.101(4) Uiso 0.50 1 d PD N 2
H500 H 0.1386 0.4708 0.9658 0.152 Uiso 0.50 1 calc PR N 2
H501 H 0.1686 0.4269 0.9800 0.152 Uiso 0.50 1 calc PR N 2
H502 H 0.1313 0.4586 1.0046 0.152 Uiso 0.50 1 calc PR N 2
C539 C 0.0160(13) 0.4426(8) 0.9425(6) 0.101(4) Uiso 0.50 1 d PD N 2
H503 H 0.0404 0.4663 0.9326 0.152 Uiso 0.50 1 calc PR N 2
H504 H -0.0327 0.4511 0.9486 0.152 Uiso 0.50 1 calc PR N 2
H505 H 0.0110 0.4198 0.9260 0.152 Uiso 0.50 1 calc PR N 2
O70 O 0.0265(10) 0.4436(6) 0.6689(5) 0.112(4) Uiso 0.50 1 d PD O 1
C540 C 0.0845(11) 0.4567(7) 0.6613(5) 0.112(4) Uiso 0.50 1 d PD O 1
H506 H 0.1138 0.4706 0.6787 0.135 Uiso 0.50 1 calc PR O 1
N54 N 0.1128(10) 0.4539(7) 0.6308(5) 0.112(4) Uiso 0.50 1 d PD O 1
C541 C 0.0723(14) 0.4317(9) 0.6024(6) 0.112(4) Uiso 0.50 1 d PD O 1
H507 H 0.1007 0.4326 0.5824 0.168 Uiso 0.50 1 calc PR O 1
H508 H 0.0248 0.4452 0.5971 0.168 Uiso 0.50 1 calc PR O 1
H509 H 0.0647 0.4027 0.6089 0.168 Uiso 0.50 1 calc PR O 1
C542 C 0.1873(11) 0.4656(10) 0.6259(7) 0.112(4) Uiso 0.50 1 d PD O 1
H510 H 0.1972 0.4609 0.6023 0.168 Uiso 0.50 1 calc PR O 1
H511 H 0.2210 0.4488 0.6408 0.168 Uiso 0.50 1 calc PR O 1
H512 H 0.1945 0.4952 0.6315 0.168 Uiso 0.50 1 calc PR O 1
O71 O 0.1408(15) 0.5385(7) 0.5625(7) 0.151(6) Uiso 0.50 1 d PD P 2
C543 C 0.1306(14) 0.5032(8) 0.5722(5) 0.151(6) Uiso 0.50 1 d PD P 2
H513 H 0.1205 0.4830 0.5549 0.182 Uiso 0.50 1 calc PR P 2
N55 N 0.1318(14) 0.4887(7) 0.6046(5) 0.151(6) Uiso 0.50 1 d PD P 2
C544 C 0.144(2) 0.5158(9) 0.6340(6) 0.151(6) Uiso 0.50 1 d PD P 2
H514 H 0.1434 0.4991 0.6547 0.227 Uiso 0.50 1 calc PR P 2
H515 H 0.1053 0.5368 0.6336 0.227 Uiso 0.50 1 calc PR P 2
H516 H 0.1917 0.5295 0.6335 0.227 Uiso 0.50 1 calc PR P 2
C545 C 0.124(2) 0.4445(7) 0.6123(8) 0.151(6) Uiso 0.50 1 d PD P 2
H517 H 0.1276 0.4406 0.6369 0.227 Uiso 0.50 1 calc PR P 2
H518 H 0.1633 0.4288 0.6025 0.227 Uiso 0.50 1 calc PR P 2
H519 H 0.0766 0.4345 0.6026 0.227 Uiso 0.50 1 calc PR P 2
O72 O 0.1334(11) 0.5543(7) 0.5597(6) 0.118(4) Uiso 0.50 1 d PD Q 1
C546 C 0.1037(10) 0.5555(7) 0.5867(6) 0.118(4) Uiso 0.50 1 d PD Q 1
H520 H 0.1324 0.5610 0.6073 0.142 Uiso 0.50 1 calc PR Q 1
N56 N 0.0303(10) 0.5489(7) 0.5874(5) 0.118(4) Uiso 0.50 1 d PD Q 1
C547 C -0.0139(13) 0.5402(10) 0.5560(5) 0.118(4) Uiso 0.50 1 d PD Q 1
H521 H -0.0652 0.5366 0.5609 0.178 Uiso 0.50 1 calc PR Q 1
H522 H 0.0037 0.5147 0.5458 0.178 Uiso 0.50 1 calc PR Q 1
H523 H -0.0100 0.5635 0.5403 0.178 Uiso 0.50 1 calc PR Q 1
C548 C -0.0077(14) 0.5473(10) 0.6183(5) 0.118(4) Uiso 0.50 1 d PD Q 1
H524 H -0.0601 0.5428 0.6125 0.178 Uiso 0.50 1 calc PR Q 1
H525 H -0.0005 0.5736 0.6306 0.178 Uiso 0.50 1 calc PR Q 1
H526 H 0.0119 0.5243 0.6325 0.178 Uiso 0.50 1 calc PR Q 1
O73 O -0.0603(16) 0.4794(8) 0.6493(7) 0.176(7) Uiso 0.50 1 d PD R 2
C549 C -0.0522(16) 0.4914(7) 0.6200(7) 0.176(7) Uiso 0.50 1 d PD R 2
H527 H -0.0373 0.4730 0.6031 0.211 Uiso 0.50 1 calc PR R 2
N57 N -0.0663(14) 0.5331(7) 0.6136(6) 0.176(7) Uiso 0.50 1 d PD R 2
C550 C -0.091(2) 0.5589(10) 0.6411(7) 0.176(7) Uiso 0.50 1 d PD R 2
H528 H -0.0986 0.5875 0.6330 0.264 Uiso 0.50 1 calc PR R 2
H529 H -0.0536 0.5587 0.6602 0.264 Uiso 0.50 1 calc PR R 2
H530 H -0.1369 0.5477 0.6484 0.264 Uiso 0.50 1 calc PR R 2
C551 C -0.059(2) 0.5531(10) 0.5819(7) 0.176(7) Uiso 0.50 1 d PD R 2
H531 H -0.0711 0.5827 0.5838 0.264 Uiso 0.50 1 calc PR R 2
H532 H -0.0924 0.5401 0.5645 0.264 Uiso 0.50 1 calc PR R 2
H533 H -0.0085 0.5502 0.5758 0.264 Uiso 0.50 1 calc PR R 2
O74 O -0.2210(9) 0.4503(5) 0.9416(3) 0.081(3) Uiso 0.50 1 d PD S 1
C552 C -0.2096(10) 0.4260(6) 0.9655(4) 0.081(3) Uiso 0.50 1 d PD S 1
H534 H -0.1788 0.4025 0.9631 0.097 Uiso 0.50 1 calc PR S 1
N58 N -0.2409(9) 0.4323(5) 0.9960(3) 0.081(3) Uiso 0.50 1 d PD S 1
C553 C -0.2870(12) 0.4686(6) 1.0003(6) 0.081(3) Uiso 0.50 1 d PD S 1
H535 H -0.3046 0.4681 1.0231 0.121 Uiso 0.50 1 calc PR S 1
H536 H -0.3289 0.4679 0.9834 0.121 Uiso 0.50 1 calc PR S 1
H537 H -0.2586 0.4940 0.9975 0.121 Uiso 0.50 1 calc PR S 1
C554 C -0.2216(13) 0.4067(6) 1.0244(4) 0.081(3) Uiso 0.50 1 d PD S 1
H538 H -0.2488 0.4155 1.0435 0.121 Uiso 0.50 1 calc PR S 1
H539 H -0.1689 0.4091 1.0307 0.121 Uiso 0.50 1 calc PR S 1
H540 H -0.2336 0.3776 1.0188 0.121 Uiso 0.50 1 calc PR S 1
O75 O -0.1849(16) 0.4503(10) 0.9485(8) 0.093(7) Uiso 0.25 1 d PD T 2
C555 C -0.2280(16) 0.4262(10) 0.9584(6) 0.093(7) Uiso 0.25 1 d PD T 2
H541 H -0.2551 0.4108 0.9412 0.112 Uiso 0.25 1 calc PR T 2
N59 N -0.2440(16) 0.4176(9) 0.9908(6) 0.093(7) Uiso 0.25 1 d PD T 2
C556 C -0.205(2) 0.4359(14) 1.0203(7) 0.093(7) Uiso 0.25 1 d PD T 2
H542 H -0.2256 0.4256 1.0408 0.140 Uiso 0.25 1 calc PR T 2
H543 H -0.2092 0.4663 1.0192 0.140 Uiso 0.25 1 calc PR T 2
H544 H -0.1530 0.4281 1.0209 0.140 Uiso 0.25 1 calc PR T 2
C557 C -0.287(2) 0.3805(11) 0.9972(10) 0.093(7) Uiso 0.25 1 d PD T 2
H545 H -0.2938 0.3786 1.0214 0.140 Uiso 0.25 1 calc PR T 2
H546 H -0.2612 0.3557 0.9900 0.140 Uiso 0.25 1 calc PR T 2
H547 H -0.3349 0.3824 0.9844 0.140 Uiso 0.25 1 calc PR T 2
O76 O 0.9070(16) 0.7882(10) 0.7063(7) 0.102(7) Uiso 0.25 1 d PD U 1
C558 C 0.8698(18) 0.7938(9) 0.6812(6) 0.102(7) Uiso 0.25 1 d PD U 1
H548 H 0.8284 0.7759 0.6795 0.122 Uiso 0.25 1 calc PR U 1
N60 N 0.8712(15) 0.8193(9) 0.6543(7) 0.102(7) Uiso 0.25 1 d PD U 1
C559 C 0.9293(19) 0.8498(13) 0.6502(12) 0.102(7) Uiso 0.25 1 d PD U 1
H549 H 0.9183 0.8653 0.6291 0.153 Uiso 0.25 1 calc PR U 1
H550 H 0.9762 0.8354 0.6494 0.153 Uiso 0.25 1 calc PR U 1
H551 H 0.9321 0.8692 0.6694 0.153 Uiso 0.25 1 calc PR U 1
C560 C 0.811(2) 0.8200(15) 0.6276(9) 0.102(7) Uiso 0.25 1 d PD U 1
H552 H 0.8208 0.8411 0.6107 0.153 Uiso 0.25 1 calc PR U 1
H553 H 0.7650 0.8266 0.6376 0.153 Uiso 0.25 1 calc PR U 1
H554 H 0.8067 0.7926 0.6167 0.153 Uiso 0.25 1 calc PR U 1
O77 O 1.0433(16) 0.8208(19) 0.6802(16) 0.23(2) Uiso 0.25 1 d PD V 2
C561 C 0.9862(16) 0.8398(14) 0.6794(13) 0.23(2) Uiso 0.25 1 d PD V 2
H555 H 0.9832 0.8660 0.6682 0.281 Uiso 0.25 1 calc PR V 2
N61 N 0.9252(16) 0.8253(12) 0.6940(12) 0.23(2) Uiso 0.25 1 d PD V 2
C562 C 0.923(3) 0.7856(17) 0.711(2) 0.23(2) Uiso 0.25 1 d PD V 2
H556 H 0.8753 0.7818 0.7201 0.352 Uiso 0.25 1 calc PR V 2
H557 H 0.9615 0.7849 0.7299 0.352 Uiso 0.25 1 calc PR V 2
H558 H 0.9317 0.7631 0.6952 0.352 Uiso 0.25 1 calc PR V 2
C563 C 0.858(2) 0.850(2) 0.692(2) 0.23(2) Uiso 0.25 1 d PD V 2
H559 H 0.8215 0.8354 0.7048 0.352 Uiso 0.25 1 calc PR V 2
H560 H 0.8391 0.8522 0.6683 0.352 Uiso 0.25 1 calc PR V 2
H561 H 0.8679 0.8773 0.7016 0.352 Uiso 0.25 1 calc PR V 2
O78 O -0.0892(14) 0.4550(12) 0.7966(11) 0.128(10) Uiso 0.25 1 d PD W 1
C564 C -0.0290(14) 0.4469(11) 0.8060(9) 0.128(10) Uiso 0.25 1 d PD W 1
H562 H -0.0138 0.4607 0.8265 0.154 Uiso 0.25 1 calc PR W 1
N62 N 0.0246(14) 0.4229(11) 0.7948(9) 0.128(10) Uiso 0.25 1 d PD W 1
C565 C 0.019(3) 0.3987(17) 0.7636(11) 0.128(10) Uiso 0.25 1 d PD W 1
H563 H 0.0657 0.3841 0.7613 0.193 Uiso 0.25 1 calc PR W 1
H564 H 0.0093 0.4174 0.7442 0.193 Uiso 0.25 1 calc PR W 1
H565 H -0.0203 0.3783 0.7642 0.193 Uiso 0.25 1 calc PR W 1
C566 C 0.0976(16) 0.4230(18) 0.8131(13) 0.128(10) Uiso 0.25 1 d PD W 1
H566 H 0.1297 0.4038 0.8019 0.193 Uiso 0.25 1 calc PR W 1
H567 H 0.0937 0.4139 0.8365 0.193 Uiso 0.25 1 calc PR W 1
H568 H 0.1181 0.4511 0.8130 0.193 Uiso 0.25 1 calc PR W 1
O79 O 0.0776(15) 0.4090(15) 0.7779(12) 0.160(13) Uiso 0.25 1 d PD X 2
C567 C 0.0249(14) 0.4221(14) 0.7911(10) 0.160(13) Uiso 0.25 1 d PD X 2
H569 H 0.0313 0.4368 0.8120 0.192 Uiso 0.25 1 calc PR X 2
N63 N -0.0451(13) 0.4154(12) 0.7759(9) 0.160(13) Uiso 0.25 1 d PD X 2
C568 C -0.054(3) 0.392(2) 0.7442(12) 0.160(13) Uiso 0.25 1 d PD X 2
H570 H -0.1063 0.3896 0.7372 0.240 Uiso 0.25 1 calc PR X 2
H571 H -0.0320 0.3648 0.7473 0.240 Uiso 0.25 1 calc PR X 2
H572 H -0.0299 0.4076 0.7267 0.240 Uiso 0.25 1 calc PR X 2
C569 C -0.1097(18) 0.433(2) 0.7890(16) 0.160(13) Uiso 0.25 1 d PD X 2
H573 H -0.1531 0.4235 0.7750 0.240 Uiso 0.25 1 calc PR X 2
H574 H -0.1069 0.4632 0.7886 0.240 Uiso 0.25 1 calc PR X 2
H575 H -0.1130 0.4232 0.8123 0.240 Uiso 0.25 1 calc PR X 2
O80 O -0.2415(17) 0.4284(13) 0.7999(10) 0.141(11) Uiso 0.25 1 d PD Y 1
C570 C -0.2810(16) 0.4274(11) 0.8232(9) 0.141(11) Uiso 0.25 1 d PD Y 1
H576 H -0.2711 0.4458 0.8417 0.169 Uiso 0.25 1 calc PR Y 1
N64 N -0.3398(16) 0.4004(11) 0.8235(8) 0.141(11) Uiso 0.25 1 d PD Y 1
C571 C -0.356(3) 0.3710(15) 0.7958(12) 0.141(11) Uiso 0.25 1 d PD Y 1
H577 H -0.3995 0.3549 0.7999 0.211 Uiso 0.25 1 calc PR Y 1
H578 H -0.3140 0.3520 0.7945 0.211 Uiso 0.25 1 calc PR Y 1
H579 H -0.3639 0.3862 0.7744 0.211 Uiso 0.25 1 calc PR Y 1
C572 C -0.385(3) 0.3980(19) 0.8520(11) 0.141(11) Uiso 0.25 1 d PD Y 1
H580 H -0.4237 0.3773 0.8472 0.211 Uiso 0.25 1 calc PR Y 1
H581 H -0.4069 0.4252 0.8557 0.211 Uiso 0.25 1 calc PR Y 1
H582 H -0.3545 0.3896 0.8724 0.211 Uiso 0.25 1 calc PR Y 1
O81 O -0.2332(14) 0.4518(9) 0.8278(8) 0.094(6) Uiso 0.25 1 d PD Z 2
C573 C -0.2863(15) 0.4302(8) 0.8309(7) 0.094(6) Uiso 0.25 1 d PD Z 2
H583 H -0.3103 0.4348 0.8510 0.113 Uiso 0.25 1 calc PR Z 2
N65 N -0.3168(14) 0.4001(8) 0.8099(7) 0.094(6) Uiso 0.25 1 d PD Z 2
C574 C -0.289(2) 0.3872(14) 0.7784(8) 0.094(6) Uiso 0.25 1 d PD Z 2
H584 H -0.3197 0.3652 0.7680 0.141 Uiso 0.25 1 calc PR Z 2
H585 H -0.2386 0.3767 0.7829 0.141 Uiso 0.25 1 calc PR Z 2
H586 H -0.2883 0.4111 0.7630 0.141 Uiso 0.25 1 calc PR Z 2
C575 C -0.3817(19) 0.3762(13) 0.8185(11) 0.094(6) Uiso 0.25 1 d PD Z 2
H587 H -0.3951 0.3562 0.8004 0.141 Uiso 0.25 1 calc PR Z 2
H588 H -0.4226 0.3954 0.8209 0.141 Uiso 0.25 1 calc PR Z 2
H589 H -0.3704 0.3613 0.8398 0.141 Uiso 0.25 1 calc PR Z 2
O82 O 0.3541(14) 0.4720(7) 0.7445(6) 0.143(6) Uiso 0.50 1 d PD A 1
C576 C 0.3283(14) 0.4412(7) 0.7536(6) 0.143(6) Uiso 0.50 1 d PD A 1
H590 H 0.2826 0.4336 0.7423 0.172 Uiso 0.50 1 calc PR A 1
N66 N 0.3559(13) 0.4146(7) 0.7786(6) 0.143(6) Uiso 0.50 1 d PD A 1
C577 C 0.4211(15) 0.4236(10) 0.8007(8) 0.143(6) Uiso 0.50 1 d PD A 1
H591 H 0.4307 0.4004 0.8165 0.215 Uiso 0.50 1 calc PR A 1
H592 H 0.4135 0.4492 0.8135 0.215 Uiso 0.50 1 calc PR A 1
H593 H 0.4629 0.4272 0.7870 0.215 Uiso 0.50 1 calc PR A 1
C578 C 0.3158(17) 0.3776(8) 0.7858(8) 0.143(6) Uiso 0.50 1 d PD A 1
H594 H 0.3429 0.3618 0.8039 0.215 Uiso 0.50 1 calc PR A 1
H595 H 0.3094 0.3604 0.7654 0.215 Uiso 0.50 1 calc PR A 1
H596 H 0.2677 0.3853 0.7930 0.215 Uiso 0.50 1 calc PR A 1
O83 O 0.2394(15) 0.4484(12) 0.7427(9) 0.115(8) Uiso 0.25 1 d PD B 2
C579 C 0.2776(13) 0.4249(11) 0.7599(9) 0.115(8) Uiso 0.25 1 d PD B 2
H597 H 0.2577 0.3991 0.7666 0.138 Uiso 0.25 1 calc PR B 2
N67 N 0.3492(13) 0.4343(9) 0.7702(9) 0.115(8) Uiso 0.25 1 d PD B 2
C580 C 0.381(2) 0.4735(11) 0.7607(15) 0.115(8) Uiso 0.25 1 d PD B 2
H598 H 0.4319 0.4752 0.7709 0.173 Uiso 0.25 1 calc PR B 2
H599 H 0.3528 0.4967 0.7688 0.173 Uiso 0.25 1 calc PR B 2
H600 H 0.3815 0.4750 0.7360 0.173 Uiso 0.25 1 calc PR B 2
C581 C 0.396(2) 0.4070(14) 0.7914(14) 0.115(8) Uiso 0.25 1 d PD B 2
H601 H 0.4434 0.4205 0.7968 0.173 Uiso 0.25 1 calc PR B 2
H602 H 0.4030 0.3808 0.7795 0.173 Uiso 0.25 1 calc PR B 2
H603 H 0.3729 0.4013 0.8125 0.173 Uiso 0.25 1 calc PR B 2
C582 C 0.5139(10) 0.6473(5) 1.0020(5) 0.131(6) Uiso 1 1 d D . .
H604 H 0.5187 0.6226 1.0165 0.196 Uiso 1 1 calc R . .
H605 H 0.5350 0.6416 0.9805 0.196 Uiso 1 1 calc R . .
H606 H 0.4620 0.6544 0.9976 0.196 Uiso 1 1 calc R . .
C583 C 0.5527(10) 0.6822(5) 1.0190(4) 0.130(6) Uiso 1 1 d D . .
H607 H 0.6052 0.6752 1.0236 0.156 Uiso 1 1 calc R . .
H608 H 0.5321 0.6879 1.0410 0.156 Uiso 1 1 calc R . .
O84 O 0.5447(10) 0.7192(4) 0.9971(4) 0.220(8) Uiso 1 1 d D . .
C584 C 0.6003(13) 0.7505(6) 1.0086(9) 0.293(19) Uiso 1 1 d D . .
H609 H 0.6278 0.7410 1.0297 0.351 Uiso 1 1 calc R . .
H610 H 0.6354 0.7545 0.9911 0.351 Uiso 1 1 calc R . .
C585 C 0.5623(15) 0.7901(6) 1.0147(7) 0.219(13) Uiso 1 1 d D . .
H611 H 0.5984 0.8114 1.0223 0.328 Uiso 1 1 calc R . .
H612 H 0.5280 0.7859 1.0321 0.328 Uiso 1 1 calc R . .
H613 H 0.5354 0.7994 0.9936 0.328 Uiso 1 1 calc R . .
O85 O -0.0157(9) 0.5040(5) 0.8727(4) 0.180(6) Uani 1 1 d D . .
H614 H 0.017(4) 0.510(4) 0.889(3) 0.270 Uiso 1 1 d D . .
H615 H -0.060(2) 0.494(4) 0.870(2) 0.270 Uiso 1 1 d D . .
O86 O -0.1631(9) 0.4822(5) 0.8839(3) 0.168(6) Uani 1 1 d D . .
H616 H -0.176(7) 0.476(6) 0.8633(13) 0.251 Uiso 1 1 d D . .
H617 H -0.181(6) 0.473(7) 0.902(3) 0.251 Uiso 1 1 d D . .
O87 O 0.5752(5) 0.6938(4) 0.9313(3) 0.112(3) Uani 1 1 d D . .
H618 H 0.543(3) 0.676(3) 0.924(4) 0.168 Uiso 1 1 d D . .
H619 H 0.558(6) 0.698(5) 0.9509(16) 0.168 Uiso 1 1 d D . .
O88 O 0.6982(5) 0.8252(4) 0.6955(3) 0.116(4) Uani 1 1 d D . .
H620 H 0.6527(11) 0.820(4) 0.692(5) 0.174 Uiso 1 1 d D . .
H621 H 0.718(6) 0.816(3) 0.7143(12) 0.174 Uiso 1 1 d D . .
O89 O 0.1806(9) 0.8306(7) 0.5114(5) 0.304(14) Uani 1 1 d D . .
H622 H 0.226(2) 0.825(5) 0.515(6) 0.456 Uiso 1 1 d D . .
H623 H 0.167(10) 0.825(10) 0.491(2) 0.456 Uiso 1 1 d D . .
O90 O 0.7560(7) 0.5283(6) 0.5768(3) 0.169(6) Uani 1 1 d D . .
H624 H 0.730(4) 0.541(6) 0.561(3) 0.253 Uiso 1 1 d D . .
H625 H 0.756(8) 0.522(6) 0.5978(13) 0.253 Uiso 1 1 d D . .
O91 O 0.8097(11) 0.9483(6) 0.6334(5) 0.105(6) Uiso 0.50 1 d PD . .
H626 H 0.849(3) 0.961(4) 0.640(6) 0.157 Uiso 0.50 1 d PD . .
H627 H 0.816(9) 0.939(8) 0.614(2) 0.157 Uiso 0.50 1 d PD . .
O92 O 0.7682(13) 0.9115(7) 0.6905(5) 0.267(10) Uani 1 1 d DU . .
H628 H 0.752(7) 0.8866(17) 0.687(3) 0.400 Uiso 1 1 d D . .
H629 H 0.788(8) 0.926(5) 0.6759(18) 0.400 Uiso 1 1 d D . .
O93 O 0.7662(8) 0.9926(5) 0.7934(4) 0.212(8) Uani 1 1 d D . .
H630 H 0.742(7) 0.987(10) 0.810(3) 0.318 Uiso 1 1 d D . .
H631 H 0.742(6) 1.009(4) 0.780(3) 0.318 Uiso 1 1 d D . .
O94 O 0.8576(9) 0.9437(6) 0.7504(6) 0.236(10) Uani 1 1 d D . .
H632 H 0.833(7) 0.938(5) 0.732(2) 0.354 Uiso 1 1 d D . .
H633 H 0.828(5) 0.959(6) 0.760(4) 0.354 Uiso 1 1 d D . .
O95 O 1.0403(9) 0.8368(7) 0.7289(4) 0.202(7) Uani 1 1 d D C 1
H634 H 1.001(3) 0.826(3) 0.720(3) 0.302 Uiso 1 1 d D D 1
H635 H 1.066(5) 0.835(8) 0.712(2) 0.302 Uiso 1 1 d D E 1
O96 O 0.9785(9) 0.9003(4) 0.7713(4) 0.193(7) Uani 1 1 d D . .
H636 H 0.944(3) 0.917(3) 0.765(6) 0.290 Uiso 1 1 d D . .
H637 H 0.993(7) 0.886(3) 0.755(2) 0.290 Uiso 1 1 d D . .
O97 O 1.0142(10) 0.9237(4) 0.8363(4) 0.190(7) Uani 1 1 d D . .
H638 H 0.996(6) 0.917(2) 0.8166(10) 0.286 Uiso 1 1 d D . .
H639 H 0.996(8) 0.948(2) 0.838(3) 0.286 Uiso 1 1 d D . .
O98 O 0.0475(12) 0.9480(9) 0.4744(6) 0.330(15) Uani 1 1 d D . .
H640 H 0.013(4) 0.930(3) 0.472(6) 0.494 Uiso 1 1 d D . .
H641 H 0.057(5) 0.937(7) 0.494(3) 0.494 Uiso 1 1 d D . .
O99 O 0.1564(16) 0.9628(9) 0.4301(8) 0.176(12) Uiso 0.50 1 d PD . .
H642 H 0.183(3) 0.9845(16) 0.433(3) 0.264 Uiso 0.50 1 d PD . .
H643 H 0.129(4) 0.964(4) 0.446(2) 0.264 Uiso 0.50 1 d PD . .
O100 O 0.1198(14) 0.9072(8) 0.5358(7) 0.179(12) Uiso 0.50 1 d PD . .
H644 H 0.137(4) 0.884(2) 0.531(4) 0.268 Uiso 0.50 1 d PD . .
H645 H 0.086(3) 0.900(4) 0.548(2) 0.268 Uiso 0.50 1 d PD . .
O101 O 0.032(2) 0.8905(9) 0.5789(7) 0.27(2) Uiso 0.50 1 d PD . .
H646 H 0.031(3) 0.90540(16) 0.5962(9) 0.399 Uiso 0.50 1 d PD . .
H647 H 0.031(5) 0.8665(5) 0.5872(14) 0.399 Uiso 0.50 1 d PD . .
O102 O 0.134(2) 0.7943(13) 0.5582(8) 0.26(2) Uiso 0.50 1 d PD . .
H648 H 0.1456(3) 0.8027(11) 0.5391(6) 0.389 Uiso 0.50 1 d PD . .
H649 H 0.106(6) 0.814(3) 0.5634(19) 0.389 Uiso 0.50 1 d PD . .
O103 O 0.5595(13) 0.5117(7) 1.0242(6) 0.131(8) Uiso 0.50 1 d PD . .
H650 H 0.570(10) 0.522(7) 1.006(3) 0.197 Uiso 0.50 1 d PD . .
H651 H 0.534(4) 0.490(3) 1.026(9) 0.197 Uiso 0.50 1 d PD . .
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'
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_3
O1 Pd1 O3 88.1(2) .
O1 Pd1 N2 176.6(3) .
O3 Pd1 N2 94.3(3) .
O1 Pd1 N1 95.4(3) .
O3 Pd1 N1 174.3(3) .
N2 Pd1 N1 82.1(3) .
O1 Pd1 Pd16 87.85(14) 1_456
O3 Pd1 Pd16 91.89(14) 1_456
N2 Pd1 Pd16 89.69(19) 1_456
N1 Pd1 Pd16 83.72(19) 1_456
O5 Pd2 N4 95.4(2) .
O5 Pd2 N3 176.6(2) .
N4 Pd2 N3 83.5(3) .
O5 Pd2 O4 87.5(3) .
N4 Pd2 O4 174.1(2) .
N3 Pd2 O4 93.4(3) .
O1 C1 C2 128.2(8) .
O1 C1 C6 114.2(7) .
C2 C1 C6 117.5(7) .
C1 C2 C3 117.7(9) .
C1 C2 C12 125.8(8) .
C3 C2 C12 116.4(8) .
C2 C3 C4 124.2(8) .
C2 C3 H1 117.9 .
C4 C3 H1 117.9 .
C5 C4 C3 116.5(8) .
C5 C4 C8 123.4(11) .
C3 C4 C8 120.1(10) .
C4 C5 C6 122.4(10) .
C4 C5 H2 118.8 .
C6 C5 H2 118.8 .
C5 C6 C1 121.5(8) .
C5 C6 C7 118.0(8) .
C1 C6 C7 120.5(7) .
C1 O1 Pd1 121.6(6) .
O2 C7 C6 126.0(8) .
O2 C7 H3 117.0 .
C6 C7 H3 117.0 .
C9 C8 C11 108.8(11) .
C9 C8 C4 112.3(11) .
C11 C8 C4 109.8(10) .
C9 C8 C10 110.4(11) .
C11 C8 C10 109.4(10) .
C4 C8 C10 106.0(9) .
C8 C9 H4 109.5 .
C8 C9 H5 109.5 .
H4 C9 H5 109.5 .
C8 C9 H6 109.5 .
H4 C9 H6 109.5 .
H5 C9 H6 109.5 .
C8 C10 H7 109.5 .
C8 C10 H8 109.5 .
H7 C10 H8 109.5 .
C8 C10 H9 109.5 .
H7 C10 H9 109.5 .
H8 C10 H9 109.5 .
C8 C11 H10 109.5 .
C8 C11 H11 109.5 .
H10 C11 H11 109.5 .
C8 C11 H12 109.5 .
H10 C11 H12 109.5 .
H11 C11 H12 109.5 .
C12 N1 C16 122.1(8) .
C12 N1 Pd1 125.7(6) .
C16 N1 Pd1 111.6(6) .
N1 C12 C13 116.6(9) .
N1 C12 C2 120.2(7) .
C13 C12 C2 123.2(9) .
C14 C13 C12 120.5(10) .
C14 C13 H13 119.8 .
C12 C13 H13 119.8 .
C15 C14 C13 121.4(10) .
C15 C14 H14 119.3 .
C13 C14 H14 119.3 .
C14 C15 C16 117.3(11) .
C14 C15 H15 121.3 .
C16 C15 H15 121.3 .
N1 C16 C15 122.0(10) .
N1 C16 C17 115.5(8) .
C15 C16 C17 122.4(10) .
C17 N2 C21 123.6(8) .
C17 N2 Pd1 113.4(7) .
C21 N2 Pd1 122.5(6) .
N2 C17 C18 120.3(11) .
N2 C17 C16 115.6(9) .
C18 C17 C16 124.1(11) .
C17 C18 C19 118.4(11) .
C17 C18 H16 120.8 .
C19 C18 H16 120.8 .
C20 C19 C18 120.6(11) .
C20 C19 H17 119.7 .
C18 C19 H17 119.7 .
C19 C20 C21 118.2(12) .
C19 C20 H18 120.9 .
C21 C20 H18 120.9 .
N2 C21 C20 118.5(10) .
N2 C21 C24 122.9(8) .
C20 C21 C24 118.4(10) .
C23 C22 C31 119.2(9) .
C23 C22 C32 118.5(7) .
C31 C22 C32 122.0(8) .
O3 C23 C22 116.0(7) .
O3 C23 C24 123.3(8) .
C22 C23 C24 120.4(8) .
C25 C24 C23 118.7(9) .
C25 C24 C21 118.5(9) .
C23 C24 C21 122.7(7) .
C26 C25 C24 121.9(10) .
C26 C25 H19 119.0 .
C24 C25 H19 119.0 .
C25 C26 C31 120.4(8) .
C25 C26 C27 122.0(12) .
C31 C26 C27 117.5(11) .
C28 C27 C26 123.7(14) .
C28 C27 H20 118.2 .
C26 C27 H20 118.2 .
C27 C28 C29 120.4(10) .
C27 C28 H21 119.8 .
C29 C28 H21 119.8 .
C30 C29 C28 118.0(12) .
C30 C29 H22 121.0 .
C28 C29 H22 121.0 .
C29 C30 C31 121.7(12) .
C29 C30 H23 119.2 .
C31 C30 H23 119.2 .
C30 C31 C26 118.7(8) .
C30 C31 C22 122.1(10) .
C26 C31 C22 119.0(9) .
C23 O3 Pd1 120.0(5) .
C41 C32 C33 120.7(8) .
C41 C32 C22 123.2(7) .
C33 C32 C22 116.0(7) .
O4 C33 C32 118.3(7) .
O4 C33 C34 123.9(7) .
C32 C33 C34 117.8(7) .
C35 C34 C33 118.6(7) .
C35 C34 C42 117.6(8) .
C33 C34 C42 123.6(7) .
C34 C35 C36 123.4(9) .
C34 C35 H24 118.3 .
C36 C35 H24 118.3 .
C41 C36 C37 119.3(8) .
C41 C36 C35 118.6(8) .
C37 C36 C35 122.1(9) .
C38 C37 C36 120.7(11) .
C38 C37 H25 119.6 .
C36 C37 H25 119.6 .
C37 C38 C39 120.5(10) .
C37 C38 H26 119.7 .
C39 C38 H26 119.7 .
C40 C39 C38 118.9(9) .
C40 C39 H27 120.6 .
C38 C39 H27 120.6 .
C39 C40 C41 122.1(11) .
C39 C40 H28 118.9 .
C41 C40 H28 118.9 .
C36 C41 C40 118.2(9) .
C36 C41 C32 120.7(7) .
C40 C41 C32 121.1(9) .
C33 O4 Pd2 120.6(5) .
C42 N3 C46 123.1(7) .
C42 N3 Pd2 124.9(5) .
C46 N3 Pd2 111.4(5) .
N3 C42 C43 117.1(7) .
N3 C42 C34 121.2(7) .
C43 C42 C34 121.8(8) .
C44 C43 C42 121.2(8) .
C44 C43 H29 119.4 .
C42 C43 H29 119.4 .
C43 C44 C45 119.0(8) .
C43 C44 H30 120.5 .
C45 C44 H30 120.5 .
C46 C45 C44 120.0(9) .
C46 C45 H31 120.0 .
C44 C45 H31 120.0 .
C45 C46 N3 119.1(8) .
C45 C46 C47 126.8(8) .
N3 C46 C47 114.0(7) .
C47 N4 C51 120.7(6) .
C47 N4 Pd2 113.1(5) .
C51 N4 Pd2 125.8(5) .
N4 C47 C48 121.9(8) .
N4 C47 C46 116.1(7) .
C48 C47 C46 122.0(8) .
C49 C48 C47 118.8(8) .
C49 C48 H32 120.6 .
C47 C48 H32 120.6 .
C48 C49 C50 119.8(7) .
C48 C49 H33 120.1 .
C50 C49 H33 120.1 .
C49 C50 C51 120.2(8) .
C49 C50 H34 119.9 .
C51 C50 H34 119.9 .
N4 C51 C50 118.6(8) .
N4 C51 C53 121.4(6) .
C50 C51 C53 120.0(7) .
O5 C52 C53 127.5(7) .
O5 C52 C57 116.5(7) .
C53 C52 C57 115.9(7) .
C54 C53 C52 118.8(7) .
C54 C53 C51 118.0(6) .
C52 C53 C51 123.2(7) .
C55 C54 C53 124.3(8) .
C55 C54 H35 117.8 .
C53 C54 H35 117.8 .
C56 C55 C54 118.0(9) .
C56 C55 C59 122.6(9) .
C54 C55 C59 119.1(9) .
C55 C56 C57 120.6(9) .
C55 C56 H36 119.7 .
C57 C56 H36 119.7 .
C56 C57 C58 118.4(8) .
C56 C57 C52 122.1(8) .
C58 C57 C52 119.5(8) .
C52 O5 Pd2 123.4(5) .
O6 C58 C57 126.3(10) .
O6 C58 H37 116.9 .
C57 C58 H37 116.9 .
C60 C59 C62 109.3(12) .
C60 C59 C61 108.7(12) .
C62 C59 C61 109.2(11) .
C60 C59 C55 111.2(10) .
C62 C59 C55 110.6(10) .
C61 C59 C55 107.7(10) .
C59 C60 H38 109.5 .
C59 C60 H39 109.5 .
H38 C60 H39 109.5 .
C59 C60 H40 109.5 .
H38 C60 H40 109.5 .
H39 C60 H40 109.5 .
C59 C61 H41 109.5 .
C59 C61 H42 109.5 .
H41 C61 H42 109.5 .
C59 C61 H43 109.5 .
H41 C61 H43 109.5 .
H42 C61 H43 109.5 .
C59 C62 H44 109.5 .
C59 C62 H45 109.5 .
H44 C62 H45 109.5 .
C59 C62 H46 109.5 .
H44 C62 H46 109.5 .
H45 C62 H46 109.5 .
N6 Pd3 N5 81.3(3) .
N6 Pd3 O9 94.8(3) .
N5 Pd3 O9 175.1(2) .
N6 Pd3 O7 175.9(2) .
N5 Pd3 O7 95.5(3) .
O9 Pd3 O7 88.2(2) .
N7 Pd4 N8 84.2(3) .
N7 Pd4 O11 176.1(2) .
N8 Pd4 O11 94.4(3) .
N7 Pd4 O10 92.4(2) .
N8 Pd4 O10 174.4(3) .
O11 Pd4 O10 88.8(2) .
N7 Pd4 Pd5 88.48(19) .
N8 Pd4 Pd5 84.1(2) .
O11 Pd4 Pd5 87.78(14) .
O10 Pd4 Pd5 91.35(16) .
O7 C63 C64 129.0(9) .
O7 C63 C68 114.7(8) .
C64 C63 C68 116.1(8) .
C63 C64 C65 118.3(9) .
C63 C64 C74 123.7(7) .
C65 C64 C74 118.0(8) .
C66 C65 C64 125.8(9) .
C66 C65 H47 117.1 .
C64 C65 H47 117.1 .
C65 C66 C67 115.0(9) .
C65 C66 C70 120.4(11) .
C67 C66 C70 124.5(11) .
C68 C67 C66 125.0(10) .
C68 C67 H48 117.5 .
C66 C67 H48 117.5 .
C67 C68 C69 121.3(9) .
C67 C68 C63 119.4(9) .
C69 C68 C63 119.2(7) .
C63 O7 Pd3 121.6(6) .
O8 C69 C68 125.1(8) .
O8 C69 H49 117.4 .
C68 C69 H49 117.4 .
C71 C70 C66 110.9(11) .
C71 C70 C73 109.7(12) .
C66 C70 C73 111.0(12) .
C71 C70 C72 110.9(13) .
C66 C70 C72 107.1(10) .
C73 C70 C72 107.2(12) .
C70 C71 H50 109.5 .
C70 C71 H51 109.5 .
H50 C71 H51 109.5 .
C70 C71 H52 109.5 .
H50 C71 H52 109.5 .
H51 C71 H52 109.5 .
C70 C72 H53 109.5 .
C70 C72 H54 109.5 .
H53 C72 H54 109.5 .
C70 C72 H55 109.5 .
H53 C72 H55 109.5 .
H54 C72 H55 109.5 .
C70 C73 H56 109.5 .
C70 C73 H57 109.5 .
H56 C73 H57 109.5 .
C70 C73 H58 109.5 .
H56 C73 H58 109.5 .
H57 C73 H58 109.5 .
C78 N5 C74 120.5(7) .
C78 N5 Pd3 114.0(6) .
C74 N5 Pd3 124.7(5) .
N5 C74 C75 119.7(8) .
N5 C74 C64 121.4(7) .
C75 C74 C64 118.9(8) .
C76 C75 C74 117.9(10) .
C76 C75 H59 121.0 .
C74 C75 H59 121.0 .
C77 C76 C75 121.1(9) .
C77 C76 H60 119.5 .
C75 C76 H60 119.5 .
C76 C77 C78 119.1(9) .
C76 C77 H61 120.5 .
C78 C77 H61 120.5 .
N5 C78 C77 121.6(9) .
N5 C78 C79 114.6(7) .
C77 C78 C79 123.7(8) .
C79 N6 C83 118.8(7) .
C79 N6 Pd3 116.4(6) .
C83 N6 Pd3 124.3(5) .
N6 C79 C80 125.0(9) .
N6 C79 C78 112.2(7) .
C80 C79 C78 122.8(8) .
C81 C80 C79 117.9(9) .
C81 C80 H62 121.1 .
C79 C80 H62 121.1 .
C80 C81 C82 121.3(9) .
C80 C81 H63 119.4 .
C82 C81 H63 119.4 .
C83 C82 C81 118.1(10) .
C83 C82 H64 121.0 .
C81 C82 H64 121.0 .
N6 C83 C82 118.9(8) .
N6 C83 C86 122.0(7) .
C82 C83 C86 118.9(8) .
C85 C84 C93 120.2(7) .
C85 C84 C94 117.5(7) .
C93 C84 C94 122.3(7) .
O9 C85 C84 116.0(6) .
O9 C85 C86 124.6(7) .
C84 C85 C86 119.5(7) .
C87 C86 C85 118.8(7) .
C87 C86 C83 118.2(7) .
C85 C86 C83 122.9(7) .
C86 C87 C88 122.5(8) .
C86 C87 H65 118.7 .
C88 C87 H65 118.7 .
C93 C88 C87 119.0(7) .
C93 C88 C89 120.3(8) .
C87 C88 C89 120.6(8) .
C90 C89 C88 120.0(9) .
C90 C89 H66 120.0 .
C88 C89 H66 120.0 .
C89 C90 C91 120.0(9) .
C89 C90 H67 120.0 .
C91 C90 H67 120.0 .
C92 C91 C90 121.6(9) .
C92 C91 H68 119.2 .
C90 C91 H68 119.2 .
C91 C92 C93 120.0(8) .
C91 C92 H69 120.0 .
C93 C92 H69 120.0 .
C88 C93 C84 119.8(7) .
C88 C93 C92 118.1(7) .
C84 C93 C92 122.1(7) .
C85 O9 Pd3 122.3(4) .
C103 C94 C95 121.2(7) .
C103 C94 C84 120.6(7) .
C95 C94 C84 118.0(7) .
O10 C95 C94 117.4(7) .
O10 C95 C96 124.9(7) .
C94 C95 C96 117.7(7) .
C97 C96 C95 121.0(7) .
C97 C96 C104 116.3(7) .
C95 C96 C104 122.7(7) .
C96 C97 C98 121.9(7) .
C96 C97 H70 119.0 .
C98 C97 H70 119.0 .
C97 C98 C103 118.9(7) .
C97 C98 C99 121.2(7) .
C103 C98 C99 119.8(7) .
C100 C99 C98 120.4(8) .
C100 C99 H71 119.8 .
C98 C99 H71 119.8 .
C99 C100 C101 119.6(8) .
C99 C100 H72 120.2 .
C101 C100 H72 120.2 .
C100 C101 C102 122.0(8) .
C100 C101 H73 119.0 .
C102 C101 H73 119.0 .
C101 C102 C103 120.3(8) .
C101 C102 H74 119.9 .
C103 C102 H74 119.9 .
C94 C103 C102 123.0(7) .
C94 C103 C98 119.1(7) .
C102 C103 C98 117.9(7) .
C95 O10 Pd4 120.8(5) .
C104 N7 C108 121.0(6) .
C104 N7 Pd4 126.1(5) .
C108 N7 Pd4 112.5(5) .
N7 C104 C105 118.7(8) .
N7 C104 C96 119.6(6) .
C105 C104 C96 121.7(8) .
C106 C105 C104 121.0(9) .
C106 C105 H75 119.5 .
C104 C105 H75 119.5 .
C105 C106 C107 119.2(8) .
C105 C106 H76 120.4 .
C107 C106 H76 120.4 .
C108 C107 C106 119.1(9) .
C108 C107 H77 120.4 .
C106 C107 H77 120.4 .
N7 C108 C107 120.6(8) .
N7 C108 C109 115.3(7) .
C107 C108 C109 124.0(8) .
C113 N8 C109 121.9(9) .
C113 N8 Pd4 127.4(7) .
C109 N8 Pd4 110.6(6) .
C110 C109 N8 120.6(9) .
C110 C109 C108 123.7(9) .
N8 C109 C108 115.7(8) .
C111 C110 C109 118.5(10) .
C111 C110 H78 120.7 .
C109 C110 H78 120.7 .
C110 C111 C112 119.1(10) .
C110 C111 H79 120.5 .
C112 C111 H79 120.5 .
C113 C112 C111 120.9(9) .
C113 C112 H80 119.5 .
C111 C112 H80 119.5 .
N8 C113 C112 118.6(9) .
N8 C113 C115 120.8(9) .
C112 C113 C115 120.2(8) .
O11 C114 C115 128.2(8) .
O11 C114 C119 114.0(9) .
C115 C114 C119 117.8(8) .
C114 C115 C116 118.2(9) .
C114 C115 C113 125.6(8) .
C116 C115 C113 116.2(10) .
C117 C116 C115 122.4(12) .
C117 C116 H81 118.8 .
C115 C116 H81 118.8 .
C118 C117 C116 118.1(10) .
C118 C117 C121 125.8(11) .
C116 C117 C121 116.0(13) .
C117 C118 C119 122.6(10) .
C117 C118 H82 118.7 .
C119 C118 H82 118.7 .
C118 C119 C114 120.5(11) .
C118 C119 C120 120.9(9) .
C114 C119 C120 118.5(9) .
C114 O11 Pd4 120.8(6) .
O12 C120 C119 123.2(10) .
O12 C120 H83 118.4 .
C119 C120 H83 118.4 .
C123 C121 C117 109.2(10) .
C123 C121 C122 115.9(13) .
C117 C121 C122 106.3(13) .
C123 C121 C124 107.2(17) .
C117 C121 C124 112.6(11) .
C122 C121 C124 105.7(10) .
C121 C122 H84 109.5 .
C121 C122 H85 109.5 .
H84 C122 H85 109.5 .
C121 C122 H86 109.5 .
H84 C122 H86 109.5 .
H85 C122 H86 109.5 .
C121 C123 H87 109.5 .
C121 C123 H88 109.5 .
H87 C123 H88 109.5 .
C121 C123 H89 109.5 .
H87 C123 H89 109.5 .
H88 C123 H89 109.5 .
C121 C124 H90 109.5 .
C121 C124 H91 109.5 .
H90 C124 H91 109.5 .
C121 C124 H92 109.5 .
H90 C124 H92 109.5 .
H91 C124 H92 109.5 .
N9 Pd5 O15 174.2(4) .
N9 Pd5 O13 96.0(4) .
O15 Pd5 O13 88.0(4) .
N9 Pd5 N10 82.7(4) .
O15 Pd5 N10 93.2(4) .
O13 Pd5 N10 178.4(5) .
N9 Pd5 Pd4 83.9(4) .
O15 Pd5 Pd4 92.4(3) .
O13 Pd5 Pd4 84.2(3) .
N10 Pd5 Pd4 94.8(5) .
O13 C125 C130 117.0(12) .
O13 C125 C126 126.3(10) .
C130 C125 C126 116.5(10) .
C125 C126 C127 115.9(12) .
C125 C126 C136 125.0(9) .
C127 C126 C136 118.3(12) .
C128 C127 C126 123.2(14) .
C128 C127 H93 118.4 .
C126 C127 H93 118.4 .
C129 C128 C127 119.5(11) .
C129 C128 C132 125.3(14) .
C127 C128 C132 115.1(15) .
C128 C129 C130 120.8(14) .
C128 C129 H94 119.6 .
C130 C129 H94 119.6 .
C129 C130 C125 124.2(14) .
C129 C130 C131 119.6(12) .
C125 C130 C131 116.2(10) .
C125 O13 Pd5 121.5(8) .
O14 C131 C130 124.0(13) .
O14 C131 H95 118.0 .
C130 C131 H95 118.0 .
C134 C132 C133 106.0(14) .
C134 C132 C135 111.7(13) .
C133 C132 C135 112.9(15) .
C134 C132 C128 109.6(14) .
C133 C132 C128 104.5(11) .
C135 C132 C128 111.9(14) .
C132 C133 H96 109.5 .
C132 C133 H97 109.5 .
H96 C133 H97 109.5 .
C132 C133 H98 109.5 .
H96 C133 H98 109.5 .
H97 C133 H98 109.5 .
C132 C134 H99 109.5 .
C132 C134 H100 109.5 .
H99 C134 H100 109.5 .
C132 C134 H101 109.5 .
H99 C134 H101 109.5 .
H100 C134 H101 109.5 .
C132 C135 H102 109.5 .
C132 C135 H103 109.5 .
H102 C135 H103 109.5 .
C132 C135 H104 109.5 .
H102 C135 H104 109.5 .
H103 C135 H104 109.5 .
C136 N9 C140 122.6(10) .
C136 N9 Pd5 124.1(9) .
C140 N9 Pd5 112.8(7) .
N9 C136 C126 122.9(11) .
N9 C136 C137 115.1(12) .
C126 C136 C137 122.1(10) .
C138 C137 C136 121.9(12) .
C138 C137 H105 119.0 .
C136 C137 H105 119.0 .
C137 C138 C139 119.8(13) .
C137 C138 H106 120.1 .
C139 C138 H106 120.1 .
C138 C139 C140 120.4(14) .
C138 C139 H107 119.8 .
C140 C139 H107 119.8 .
N9 C140 C139 120.0(11) .
N9 C140 C141 115.1(10) .
C139 C140 C141 124.7(12) .
C145 N10 C141 122.7(10) .
C145 N10 Pd5 125.6(8) .
C141 N10 Pd5 110.2(7) .
C142 C141 N10 117.9(11) .
C142 C141 C140 126.1(11) .
N10 C141 C140 115.9(10) .
C141 C142 C143 121.3(12) .
C141 C142 H108 119.3 .
C143 C142 H108 119.3 .
C144 C143 C142 118.2(11) .
C144 C143 H109 120.9 .
C142 C143 H109 120.9 .
C143 C144 C145 120.4(12) .
C143 C144 H110 119.8 .
C145 C144 H110 119.8 .
N10 C145 C144 118.6(11) .
N10 C145 C169 119.0(9) .
C144 C145 C169 122.4(9) .
C168 O15 Pd5 119.2(7) .
O18 Pd6 O16 89.4(7) .
O18 Pd6 N11 174.5(9) .
O16 Pd6 N11 94.4(6) .
O18 Pd6 N12 92.9(7) .
O16 Pd6 N12 170.7(11) .
N11 Pd6 N12 82.8(6) .
O16 C146 C151 117.9(16) .
O16 C146 C147 126.4(15) .
C151 C146 C147 115.7(14) .
C146 C147 C148 117.8(17) .
C146 C147 C157 123.7(13) .
C148 C147 C157 118.3(17) .
C149 C148 C147 121(2) .
C149 C148 H111 119.6 .
C147 C148 H111 119.6 .
C150 C149 C148 119.2(17) .
C150 C149 C153 129(2) .
C148 C149 C153 111.4(18) .
C149 C150 C151 123(2) .
C149 C150 H112 118.7 .
C151 C150 H112 118.7 .
C150 C151 C146 123(2) .
C150 C151 C152 118.4(18) .
C146 C151 C152 117.5(15) .
C146 O16 Pd6 123.5(12) .
O17 C152 C151 122(2) .
O17 C152 H113 119.1 .
C151 C152 H113 119.1 .
C155 C153 C154 108(2) .
C155 C153 C156 116(2) .
C154 C153 C156 112(2) .
C155 C153 C149 105.8(19) .
C154 C153 C149 102.9(17) .
C156 C153 C149 111.2(19) .
C153 C154 H114 109.5 .
C153 C154 H115 109.5 .
H114 C154 H115 109.5 .
C153 C154 H116 109.5 .
H114 C154 H116 109.5 .
H115 C154 H116 109.5 .
C153 C155 H117 109.5 .
C153 C155 H118 109.5 .
H117 C155 H118 109.5 .
C153 C155 H119 109.5 .
H117 C155 H119 109.5 .
H118 C155 H119 109.5 .
C153 C156 H120 109.5 .
C153 C156 H121 109.5 .
H120 C156 H121 109.5 .
C153 C156 H122 109.5 .
H120 C156 H122 109.5 .
H121 C156 H122 109.5 .
C157 N11 C161 123.4(14) .
C157 N11 Pd6 123.9(12) .
C161 N11 Pd6 112.5(10) .
N11 C157 C147 124.4(15) .
N11 C157 C158 117.7(16) .
C147 C157 C158 117.6(15) .
C159 C158 C157 116.8(18) .
C159 C158 H123 121.6 .
C157 C158 H123 121.6 .
C158 C159 C160 123(2) .
C158 C159 H124 118.6 .
C160 C159 H124 118.6 .
C159 C160 C161 122(2) .
C159 C160 H125 119.2 .
C161 C160 H125 119.2 .
N11 C161 C160 116.7(16) .
N11 C161 C162 118.3(14) .
C160 C161 C162 124.8(17) .
C166 N12 C162 123.3(14) .
C166 N12 Pd6 124.4(12) .
C162 N12 Pd6 112.2(10) .
C163 C162 C161 128.8(16) .
C163 C162 N12 116.2(16) .
C161 C162 N12 114.2(14) .
C162 C163 C164 121.8(18) .
C162 C163 H126 119.1 .
C164 C163 H126 119.1 .
C165 C164 C163 118.1(18) .
C165 C164 H127 120.9 .
C163 C164 H127 120.9 .
C164 C165 C166 120.5(18) .
C164 C165 H128 119.7 .
C166 C165 H128 119.7 .
N12 C166 C169 118.1(16) .
N12 C166 C165 118.3(16) .
C169 C166 C165 121.8(16) .
C168 O18 Pd6 120.7(13) .
O19 Pd7 O20 88.1(3) .
O19 Pd7 N13 93.3(3) .
O20 Pd7 N13 175.7(3) .
O19 Pd7 N14 174.5(3) .
O20 Pd7 N14 94.4(3) .
N13 Pd7 N14 83.9(3) .
C168 C167 C176 120.2(9) .
C168 C167 C177 117.1(7) .
C176 C167 C177 122.6(8) .
O18 C168 C167 114.9(10) .
O15 C168 C167 117.8(8) .
O18 C168 C169 125.6(10) .
O15 C168 C169 123.4(8) .
C167 C168 C169 118.4(7) .
C166 C169 C170 111.9(11) .
C166 C169 C168 125.2(12) .
C170 C169 C168 121.2(9) .
C170 C169 C145 116.3(9) .
C168 C169 C145 122.3(8) .
C171 C170 C169 120.6(9) .
C171 C170 H129 119.7 .
C169 C170 H129 119.7 .
C170 C171 C176 119.6(8) .
C170 C171 C172 119.6(11) .
C176 C171 C172 120.8(11) .
C173 C172 C171 118.9(13) .
C173 C172 H130 120.6 .
C171 C172 H130 120.6 .
C172 C173 C174 120.6(10) .
C172 C173 H131 119.7 .
C174 C173 H131 119.7 .
C175 C174 C173 123.0(13) .
C175 C174 H132 118.5 .
C173 C174 H132 118.5 .
C174 C175 C176 118.3(13) .
C174 C175 H133 120.9 .
C176 C175 H133 120.9 .
C171 C176 C175 118.2(9) .
C171 C176 C167 119.7(9) .
C175 C176 C167 121.9(10) .
C186 C177 C178 121.0(10) .
C186 C177 C167 122.1(10) .
C178 C177 C167 116.8(10) .
O19 C178 C177 119.3(9) .
O19 C178 C179 120.8(8) .
C177 C178 C179 119.9(10) .
C180 C179 C178 116.8(9) .
C180 C179 C187 118.9(9) .
C178 C179 C187 124.3(9) .
C179 C180 C181 123.0(10) .
C179 C180 H134 118.5 .
C181 C180 H134 118.5 .
C182 C181 C186 118.9(11) .
C182 C181 C180 120.9(12) .
C186 C181 C180 120.1(11) .
C183 C182 C181 121.6(13) .
C183 C182 H135 119.2 .
C181 C182 H135 119.2 .
C182 C183 C184 119.4(15) .
C182 C183 H136 120.3 .
C184 C183 H136 120.3 .
C185 C184 C183 117.1(13) .
C185 C184 H137 121.5 .
C183 C184 H137 121.5 .
C184 C185 C186 124.3(12) .
C184 C185 H138 117.8 .
C186 C185 H138 117.8 .
C185 C186 C177 122.9(10) .
C185 C186 C181 118.1(11) .
C177 C186 C181 119.0(10) .
C178 O19 Pd7 124.7(6) .
C191 N13 C187 122.6(8) .
C191 N13 Pd7 112.9(7) .
C187 N13 Pd7 124.2(6) .
N13 C187 C188 118.4(8) .
N13 C187 C179 121.2(8) .
C188 C187 C179 120.2(10) .
C189 C188 C187 118.3(10) .
C189 C188 H139 120.8 .
C187 C188 H139 120.8 .
C188 C189 C190 122.3(9) .
C188 C189 H140 118.9 .
C190 C189 H140 118.9 .
C189 C190 C191 116.2(9) .
C189 C190 H141 121.9 .
C191 C190 H141 121.9 .
N13 C191 C190 121.9(9) .
N13 C191 C192 116.8(8) .
C190 C191 C192 121.3(8) .
C196 N14 C192 123.5(7) .
C196 N14 Pd7 126.0(5) .
C192 N14 Pd7 109.9(6) .
N14 C192 C193 119.8(9) .
N14 C192 C191 115.2(7) .
C193 C192 C191 125.1(9) .
C194 C193 C192 118.0(9) .
C194 C193 H142 121.0 .
C192 C193 H142 121.0 .
C193 C194 C195 120.7(9) .
C193 C194 H143 119.6 .
C195 C194 H143 119.6 .
C194 C195 C196 122.1(10) .
C194 C195 H144 119.0 .
C196 C195 H144 119.0 .
N14 C196 C195 115.9(7) .
N14 C196 C198 121.0(7) .
C195 C196 C198 123.1(8) .
O20 C197 C202 116.2(8) .
O20 C197 C198 127.8(8) .
C202 C197 C198 116.0(8) .
C199 C198 C197 120.0(8) .
C199 C198 C196 116.3(8) .
C197 C198 C196 123.7(8) .
C198 C199 C200 122.4(8) .
C198 C199 H145 118.8 .
C200 C199 H145 118.8 .
C201 C200 C199 116.9(9) .
C201 C200 C204 122.9(9) .
C199 C200 C204 120.1(8) .
C200 C201 C202 122.7(9) .
C200 C201 H146 118.6 .
C202 C201 H146 118.6 .
C201 C202 C197 121.9(8) .
C201 C202 C203 120.3(9) .
C197 C202 C203 117.7(9) .
C197 O20 Pd7 121.9(5) .
O21 C203 C202 123.9(11) .
O21 C203 H147 118.0 .
C202 C203 H147 118.0 .
C205 C204 C206 109.5(11) .
C205 C204 C207 104.1(11) .
C206 C204 C207 110.7(11) .
C205 C204 C200 113.1(9) .
C206 C204 C200 107.4(9) .
C207 C204 C200 112.0(9) .
C204 C205 H148 109.5 .
C204 C205 H149 109.5 .
H148 C205 H149 109.5 .
C204 C205 H150 109.5 .
H148 C205 H150 109.5 .
H149 C205 H150 109.5 .
C204 C206 H151 109.5 .
C204 C206 H152 109.5 .
H151 C206 H152 109.5 .
C204 C206 H153 109.5 .
H151 C206 H153 109.5 .
H152 C206 H153 109.5 .
C204 C207 H154 109.5 .
C204 C207 H155 109.5 .
H154 C207 H155 109.5 .
C204 C207 H156 109.5 .
H154 C207 H156 109.5 .
H155 C207 H156 109.5 .
O22 Pd8 N16 176.9(2) .
O22 Pd8 O24 86.9(2) .
N16 Pd8 O24 93.4(2) .
O22 Pd8 N15 95.0(3) .
N16 Pd8 N15 84.5(3) .
O24 Pd8 N15 175.3(2) .
O22 C208 C209 129.8(9) .
O22 C208 C213 108.6(8) .
C209 C208 C213 121.6(8) .
C208 C209 C219 124.1(8) .
C208 C209 C210 114.9(10) .
C219 C209 C210 121.0(9) .
C211 C210 C209 126.7(10) .
C211 C210 H157 116.6 .
C209 C210 H157 116.6 .
C212 C211 C210 116.9(9) .
C212 C211 C215 123.1(11) .
C210 C211 C215 120.1(11) .
C211 C212 C213 122.9(11) .
C211 C212 H158 118.6 .
C213 C212 H158 118.6 .
C214 C213 C212 118.7(10) .
C214 C213 C208 124.3(8) .
C212 C213 C208 116.9(10) .
C208 O22 Pd8 119.8(6) .
O23 C214 C213 124.9(10) .
O23 C214 H159 117.6 .
C213 C214 H159 117.6 .
C217 C215 C216 111.3(11) .
C217 C215 C218 105.4(15) .
C216 C215 C218 109.8(13) .
C217 C215 C211 108.6(10) .
C216 C215 C211 111.2(12) .
C218 C215 C211 110.3(10) .
C215 C216 H160 109.5 .
C215 C216 H161 109.5 .
H160 C216 H161 109.5 .
C215 C216 H162 109.5 .
H160 C216 H162 109.5 .
H161 C216 H162 109.5 .
C215 C217 H163 109.5 .
C215 C217 H164 109.5 .
H163 C217 H164 109.5 .
C215 C217 H165 109.5 .
H163 C217 H165 109.5 .
H164 C217 H165 109.5 .
C215 C218 H166 109.5 .
C215 C218 H167 109.5 .
H166 C218 H167 109.5 .
C215 C218 H168 109.5 .
H166 C218 H168 109.5 .
H167 C218 H168 109.5 .
C219 N15 C223 123.2(7) .
C219 N15 Pd8 124.9(6) .
C223 N15 Pd8 111.6(6) .
N15 C219 C209 124.1(8) .
N15 C219 C220 115.6(9) .
C209 C219 C220 120.2(9) .
C221 C220 C219 120.5(10) .
C221 C220 H169 119.7 .
C219 C220 H169 119.7 .
C222 C221 C220 120.5(9) .
C222 C221 H170 119.8 .
C220 C221 H170 119.8 .
C221 C222 C223 118.5(10) .
C221 C222 H171 120.7 .
C223 C222 H171 120.7 .
N15 C223 C222 121.5(10) .
N15 C223 C224 116.8(7) .
C222 C223 C224 121.7(10) .
C228 N16 C224 122.7(7) .
C228 N16 Pd8 125.0(5) .
C224 N16 Pd8 111.5(6) .
C225 C224 N16 119.4(8) .
C225 C224 C223 126.3(8) .
N16 C224 C223 114.3(8) .
C226 C225 C224 119.4(8) .
C226 C225 H172 120.3 .
C224 C225 H172 120.3 .
C225 C226 C227 121.2(9) .
C225 C226 H173 119.4 .
C227 C226 H173 119.4 .
C226 C227 C228 120.8(10) .
C226 C227 H174 119.6 .
C228 C227 H174 119.6 .
N16 C228 C227 116.6(8) .
N16 C228 C231 120.5(7) .
C227 C228 C231 122.7(8) .
C238 C229 C230 120.9(7) .
C238 C229 C239 123.4(6) .
C230 C229 C239 115.6(6) .
O24 C230 C229 116.8(6) .
O24 C230 C231 123.6(6) .
C229 C230 C231 119.6(6) .
C232 C231 C230 116.5(7) .
C232 C231 C228 118.5(7) .
C230 C231 C228 124.9(7) .
C233 C232 C231 123.5(8) .
C233 C232 H175 118.2 .
C231 C232 H175 118.2 .
C232 C233 C238 120.2(7) .
C232 C233 C234 122.0(8) .
C238 C233 C234 117.7(8) .
C235 C234 C233 121.8(9) .
C235 C234 H176 119.1 .
C233 C234 H176 119.1 .
C234 C235 C236 120.4(9) .
C234 C235 H177 119.8 .
C236 C235 H177 119.8 .
C237 C236 C235 120.9(9) .
C237 C236 H178 119.6 .
C235 C236 H178 119.6 .
C236 C237 C238 120.1(9) .
C236 C237 H179 119.9 .
C238 C237 H179 119.9 .
C233 C238 C229 119.1(7) .
C233 C238 C237 119.1(7) .
C229 C238 C237 121.7(8) .
C230 O24 Pd8 122.7(4) .
C240 C239 C248 118.2(6) .
C240 C239 C229 118.0(6) .
C248 C239 C229 123.8(7) .
O25 C240 C239 115.8(7) .
C239 C240 O28 111.7(12) .
O25 C240 C241 123.3(7) .
C239 C240 C241 120.8(6) .
O28 C240 C241 127.2(11) .
C242 C241 C240 118.2(8) .
C242 C241 C249 116.3(8) .
C240 C241 C249 125.5(7) .
C242 C241 C270 127.5(11) .
C240 C241 C270 113.8(9) .
C241 C242 C243 125.2(8) .
C241 C242 H180 117.4 .
C243 C242 H180 117.4 .
C244 C243 C242 124.4(9) .
C244 C243 C248 119.4(9) .
C242 C243 C248 116.0(7) .
C245 C244 C243 122.8(10) .
C245 C244 H181 118.6 .
C243 C244 H181 118.6 .
C244 C245 C246 119.7(8) .
C244 C245 H182 120.2 .
C246 C245 H182 120.2 .
C247 C246 C245 119.9(9) .
C247 C246 H183 120.0 .
C245 C246 H183 120.0 .
C246 C247 C248 121.8(9) .
C246 C247 H184 119.1 .
C248 C247 H184 119.1 .
C243 C248 C247 116.4(7) .
C243 C248 C239 121.4(7) .
C247 C248 C239 122.2(7) .
O26 Pd9 N18 94.9(3) .
O26 Pd9 N17 173.7(3) .
N18 Pd9 N17 84.6(4) .
O26 Pd9 O25 86.7(3) .
N18 Pd9 O25 176.7(4) .
N17 Pd9 O25 93.4(3) .
O26 Pd9 Pd11 80.0(2) .
N18 Pd9 Pd11 83.2(3) .
N17 Pd9 Pd11 93.7(3) .
O25 Pd9 Pd11 94.3(4) .
C240 O25 Pd9 119.0(7) .
C249 N17 C253 121.7(9) .
C249 N17 Pd9 125.1(7) .
C253 N17 Pd9 112.3(7) .
N17 C249 C250 117.7(10) .
N17 C249 C241 119.6(8) .
C250 C249 C241 122.5(9) .
C251 C250 C249 121.1(11) .
C251 C250 H185 119.4 .
C249 C250 H185 119.4 .
C250 C251 C252 119.2(11) .
C250 C251 H186 120.4 .
C252 C251 H186 120.4 .
C253 C252 C251 118.8(11) .
C253 C252 H187 120.6 .
C251 C252 H187 120.6 .
C252 C253 N17 121.4(11) .
C252 C253 C254 124.3(10) .
N17 C253 C254 114.2(9) .
C258 N18 C254 118.6(9) .
C258 N18 Pd9 127.9(8) .
C254 N18 Pd9 112.2(7) .
C255 C254 N18 121.5(11) .
C255 C254 C253 124.2(11) .
N18 C254 C253 114.2(8) .
C254 C255 C256 118.4(13) .
C254 C255 H188 120.8 .
C256 C255 H188 120.8 .
C257 C256 C255 120.3(11) .
C257 C256 H189 119.8 .
C255 C256 H189 119.8 .
C256 C257 C258 123.3(12) .
C256 C257 H190 118.3 .
C258 C257 H190 118.3 .
N18 C258 C257 117.2(11) .
N18 C258 C260 119.5(9) .
C257 C258 C260 123.2(10) .
O26 C259 C264 118.9(9) .
O26 C259 C260 128.9(9) .
C264 C259 C260 111.9(8) .
C261 C260 C259 118.3(11) .
C261 C260 C258 118.7(10) .
C259 C260 C258 122.9(8) .
C262 C261 C260 128.8(13) .
C262 C261 H191 115.6 .
C260 C261 H191 115.6 .
C261 C262 C263 116.5(10) .
C261 C262 C266 124.3(13) .
C263 C262 C266 118.6(12) .
C264 C263 C262 115.3(12) .
C264 C263 H192 122.3 .
C262 C263 H192 122.3 .
C263 C264 C259 128.6(12) .
C263 C264 C265 113.8(10) .
C259 C264 C265 117.3(8) .
C259 O26 Pd9 121.6(7) .
O27 C265 C264 124.3(10) .
O27 C265 H193 117.9 .
C264 C265 H193 117.9 .
C269 C266 C268 110.6(15) .
C269 C266 C267 108.5(12) .
C268 C266 C267 109.4(13) .
C269 C266 C262 109.6(13) .
C268 C266 C262 108.5(11) .
C267 C266 C262 110.2(11) .
C266 C267 H194 109.5 .
C266 C267 H195 109.5 .
H194 C267 H195 109.5 .
C266 C267 H196 109.5 .
H194 C267 H196 109.5 .
H195 C267 H196 109.5 .
C266 C268 H197 109.5 .
C266 C268 H198 109.5 .
H197 C268 H198 109.5 .
C266 C268 H199 109.5 .
H197 C268 H199 109.5 .
H198 C268 H199 109.5 .
C266 C269 H200 109.5 .
C266 C269 H201 109.5 .
H200 C269 H201 109.5 .
C266 C269 H202 109.5 .
H200 C269 H202 109.5 .
H201 C269 H202 109.5 .
O29 Pd10 N20 97.5(7) .
O29 Pd10 O28 86.1(8) .
N20 Pd10 O28 174.8(14) .
O29 Pd10 N19 178.7(8) .
N20 Pd10 N19 83.8(7) .
O28 Pd10 N19 92.5(8) .
C240 O28 Pd10 127.3(17) .
C274 N19 C270 121.7(16) .
C274 N19 Pd10 112.0(13) .
C270 N19 Pd10 125.0(14) .
N19 C270 C271 119(2) .
N19 C270 C241 126.7(17) .
C271 C270 C241 114.0(17) .
C272 C271 C270 118(2) .
C272 C271 H203 120.8 .
C270 C271 H203 120.8 .
C273 C272 C271 119(2) .
C273 C272 H204 120.4 .
C271 C272 H204 120.4 .
C274 C273 C272 120(2) .
C274 C273 H205 119.8 .
C272 C273 H205 119.8 .
N19 C274 C273 119.8(19) .
N19 C274 C275 115.8(17) .
C273 C274 C275 124.4(18) .
C275 N20 C279 118.3(16) .
C275 N20 Pd10 115.0(12) .
C279 N20 Pd10 123.3(13) .
C276 C275 N20 122.8(19) .
C276 C275 C274 125(2) .
N20 C275 C274 111.3(15) .
C275 C276 C277 116(2) .
C275 C276 H206 121.9 .
C277 C276 H206 121.9 .
C278 C277 C276 121(2) .
C278 C277 H207 119.7 .
C276 C277 H207 119.7 .
C277 C278 C279 124(2) .
C277 C278 H208 117.8 .
C279 C278 H208 117.8 .
N20 C279 C278 112.6(19) .
N20 C279 C281 120.2(15) .
C278 C279 C281 124.1(19) .
O29 C280 C281 125.8(17) .
O29 C280 C285 118.3(16) .
C281 C280 C285 115.5(15) .
C280 C281 C282 117.8(19) .
C280 C281 C279 127.3(15) .
C282 C281 C279 114.5(17) .
C283 C282 C281 125(2) .
C283 C282 H209 117.5 .
C281 C282 H209 117.5 .
C282 C283 C284 119.1(18) .
C282 C283 C287 124(2) .
C284 C283 C287 116(2) .
C285 C284 C283 115(2) .
C285 C284 H210 122.7 .
C283 C284 H210 122.7 .
C284 C285 C280 124(2) .
C284 C285 C286 116.7(19) .
C280 C285 C286 117.3(16) .
C280 O29 Pd10 123.3(14) .
O30 C286 C285 121(2) .
O30 C286 H211 119.5 .
C285 C286 H211 119.5 .
C290 C287 C289 113(3) .
C290 C287 C288 105(2) .
C289 C287 C288 109(2) .
C290 C287 C283 110(2) .
C289 C287 C283 109(2) .
C288 C287 C283 109(2) .
C287 C288 H212 109.5 .
C287 C288 H213 109.5 .
H212 C288 H213 109.5 .
C287 C288 H214 109.5 .
H212 C288 H214 109.5 .
H213 C288 H214 109.5 .
C287 C289 H215 109.5 .
C287 C289 H216 109.5 .
H215 C289 H216 109.5 .
C287 C289 H217 109.5 .
H215 C289 H217 109.5 .
H216 C289 H217 109.5 .
C287 C290 H218 109.5 .
C287 C290 H219 109.5 .
H218 C290 H219 109.5 .
C287 C290 H220 109.5 .
H218 C290 H220 109.5 .
H219 C290 H220 109.5 .
N21 Pd11 O33 175.0(3) .
N21 Pd11 N22 83.6(3) .
O33 Pd11 N22 92.8(3) .
N21 Pd11 O31 94.5(3) .
O33 Pd11 O31 88.9(2) .
N22 Pd11 O31 176.4(2) .
N21 Pd11 Pd9 84.33(18) .
O33 Pd11 Pd9 92.12(16) .
N22 Pd11 Pd9 87.38(17) .
O31 Pd11 Pd9 89.36(14) .
N23 Pd12 O34 94.4(3) .
N23 Pd12 N24 84.2(3) .
O34 Pd12 N24 175.9(2) .
N23 Pd12 O35 177.5(2) .
O34 Pd12 O35 87.0(2) .
N24 Pd12 O35 94.2(2) .
N23 Pd12 Pd13 91.52(19) .
O34 Pd12 Pd13 94.98(16) .
N24 Pd12 Pd13 81.17(16) .
O35 Pd12 Pd13 86.27(14) .
O31 C291 C296 117.4(9) .
O31 C291 C292 125.4(8) .
C296 C291 C292 117.2(9) .
C293 C292 C291 117.1(9) .
C293 C292 C302 116.3(10) .
C291 C292 C302 126.0(8) .
C294 C293 C292 124.2(11) .
C294 C293 H221 117.9 .
C292 C293 H221 117.9 .
C295 C294 C293 116.2(10) .
C295 C294 C298 124.8(10) .
C293 C294 C298 118.3(11) .
C296 C295 C294 123.2(10) .
C296 C295 H222 118.4 .
C294 C295 H222 118.4 .
C295 C296 C297 122.3(9) .
C295 C296 C291 121.6(10) .
C297 C296 C291 116.0(9) .
C291 O31 Pd11 123.2(6) .
O32 C297 C296 123.8(10) .
O32 C297 H223 118.1 .
C296 C297 H223 118.1 .
C301 C298 C300 108.3(12) .
C301 C298 C294 113.7(9) .
C300 C298 C294 108.3(9) .
C301 C298 C299 109.1(10) .
C300 C298 C299 109.1(9) .
C294 C298 C299 108.3(11) .
C298 C299 H224 109.5 .
C298 C299 H225 109.5 .
H224 C299 H225 109.5 .
C298 C299 H226 109.5 .
H224 C299 H226 109.5 .
H225 C299 H226 109.5 .
C298 C300 H227 109.5 .
C298 C300 H228 109.5 .
H227 C300 H228 109.5 .
C298 C300 H229 109.5 .
H227 C300 H229 109.5 .
H228 C300 H229 109.5 .
C298 C301 H230 109.5 .
C298 C301 H231 109.5 .
H230 C301 H231 109.5 .
C298 C301 H232 109.5 .
H230 C301 H232 109.5 .
H231 C301 H232 109.5 .
C302 N21 C306 120.3(8) .
C302 N21 Pd11 126.5(6) .
C306 N21 Pd11 111.9(6) .
N21 C302 C303 117.4(8) .
N21 C302 C292 119.0(8) .
C303 C302 C292 123.6(9) .
C304 C303 C302 123.9(9) .
C304 C303 H233 118.0 .
C302 C303 H233 118.0 .
C303 C304 C305 117.7(10) .
C303 C304 H234 121.2 .
C305 C304 H234 121.2 .
C306 C305 C304 119.5(9) .
C306 C305 H235 120.2 .
C304 C305 H235 120.3 .
C305 C306 N21 121.0(8) .
C305 C306 C307 124.6(8) .
N21 C306 C307 114.2(8) .
C311 N22 C307 123.0(6) .
C311 N22 Pd11 126.0(5) .
C307 N22 Pd11 110.2(5) .
N22 C307 C308 116.3(7) .
N22 C307 C306 117.1(7) .
C308 C307 C306 126.6(8) .
C309 C308 C307 122.6(8) .
C309 C308 H236 118.7 .
C307 C308 H236 118.7 .
C308 C309 C310 118.7(7) .
C308 C309 H237 120.6 .
C310 C309 H237 120.6 .
C309 C310 C311 119.8(9) .
C309 C310 H238 120.1 .
C311 C310 H238 120.1 .
N22 C311 C310 119.4(8) .
N22 C311 C314 119.5(6) .
C310 C311 C314 121.1(8) .
C313 C312 C321 122.1(7) .
C313 C312 C322 116.6(7) .
C321 C312 C322 121.1(8) .
O33 C313 C312 117.8(7) .
O33 C313 C314 124.3(7) .
C312 C313 C314 117.9(7) .
C315 C314 C313 120.2(7) .
C315 C314 C311 116.5(7) .
C313 C314 C311 123.2(7) .
C314 C315 C316 121.4(7) .
C314 C315 H239 119.3 .
C316 C315 H239 119.3 .
C315 C316 C321 119.7(8) .
C315 C316 C317 119.9(8) .
C321 C316 C317 120.3(9) .
C318 C317 C316 118.3(10) .
C318 C317 H240 120.9 .
C316 C317 H240 120.9 .
C317 C318 C319 121.4(10) .
C317 C318 H241 119.3 .
C319 C318 H241 119.3 .
C320 C319 C318 122.2(10) .
C320 C319 H242 118.9 .
C318 C319 H242 118.9 .
C319 C320 C321 120.1(10) .
C319 C320 H243 120.0 .
C321 C320 H243 120.0 .
C312 C321 C316 118.5(8) .
C312 C321 C320 124.0(8) .
C316 C321 C320 117.6(8) .
C313 O33 Pd11 120.2(5) .
C323 C322 C331 120.0(7) .
C323 C322 C312 118.4(7) .
C331 C322 C312 121.6(7) .
O34 C323 C322 115.3(7) .
O34 C323 C324 123.9(7) .
C322 C323 C324 120.8(7) .
C325 C324 C323 117.5(7) .
C325 C324 C332 117.7(7) .
C323 C324 C332 124.8(7) .
C324 C325 C326 122.5(8) .
C324 C325 H244 118.7 .
C326 C325 H244 118.7 .
C331 C326 C325 119.4(7) .
C331 C326 C327 120.9(9) .
C325 C326 C327 119.7(9) .
C328 C327 C326 120.2(10) .
C328 C327 H245 119.9 .
C326 C327 H245 119.9 .
C327 C328 C329 118.4(9) .
C327 C328 H246 120.8 .
C329 C328 H246 120.8 .
C330 C329 C328 123.4(10) .
C330 C329 H247 118.3 .
C328 C329 H247 118.3 .
C329 C330 C331 118.9(9) .
C329 C330 H248 120.6 .
C331 C330 H248 120.6 .
C326 C331 C330 118.3(8) .
C326 C331 C322 119.8(8) .
C330 C331 C322 121.9(8) .
C323 O34 Pd12 120.2(5) .
C332 N23 C336 121.3(7) .
C332 N23 Pd12 126.3(5) .
C336 N23 Pd12 111.8(5) .
N23 C332 C333 119.0(8) .
N23 C332 C324 120.5(7) .
C333 C332 C324 120.4(8) .
C334 C333 C332 119.6(9) .
C334 C333 H249 120.2 .
C332 C333 H249 120.2 .
C333 C334 C335 120.0(8) .
C333 C334 H250 120.0 .
C335 C334 H250 120.0 .
C336 C335 C334 118.9(9) .
C336 C335 H251 120.5 .
C334 C335 H251 120.5 .
C335 C336 N23 121.0(8) .
C335 C336 C337 122.9(8) .
N23 C336 C337 116.0(7) .
C341 N24 C337 120.8(6) .
C341 N24 Pd12 126.8(5) .
C337 N24 Pd12 112.0(5) .
C338 C337 N24 121.6(8) .
C338 C337 C336 123.9(7) .
N24 C337 C336 114.5(7) .
C337 C338 C339 118.3(8) .
C337 C338 H252 120.8 .
C339 C338 H252 120.8 .
C340 C339 C338 119.8(8) .
C340 C339 H253 120.1 .
C338 C339 H253 120.1 .
C339 C340 C341 121.4(9) .
C339 C340 H254 119.3 .
C341 C340 H254 119.3 .
N24 C341 C340 117.8(7) .
N24 C341 C343 120.2(7) .
C340 C341 C343 122.0(8) .
O35 C342 C343 125.0(6) .
O35 C342 C347 113.5(6) .
C343 C342 C347 121.5(7) .
C342 C343 C344 117.2(8) .
C342 C343 C341 127.5(7) .
C344 C343 C341 115.2(8) .
C343 C344 C345 122.7(8) .
C343 C344 H255 118.6 .
C345 C344 H255 118.6 .
C346 C345 C344 115.8(7) .
C346 C345 C349 126.2(8) .
C344 C345 C349 117.7(8) .
C347 C346 C345 123.3(8) .
C347 C346 H256 118.4 .
C345 C346 H256 118.4 .
C346 C347 C342 119.3(7) .
C346 C347 C348 119.0(8) .
C342 C347 C348 121.8(7) .
C342 O35 Pd12 122.5(4) .
O36 C348 C347 126.3(8) .
O36 C348 H257 116.9 .
C347 C348 H257 116.9 .
C352 C349 C345 112.9(8) .
C352 C349 C351 109.7(9) .
C345 C349 C351 107.9(8) .
C352 C349 C350 107.7(9) .
C345 C349 C350 109.0(8) .
C351 C349 C350 109.7(8) .
C349 C350 H258 109.5 .
C349 C350 H259 109.5 .
H258 C350 H259 109.5 .
C349 C350 H260 109.5 .
H258 C350 H260 109.5 .
H259 C350 H260 109.5 .
C349 C351 H261 109.5 .
C349 C351 H262 109.5 .
H261 C351 H262 109.5 .
C349 C351 H263 109.5 .
H261 C351 H263 109.5 .
H262 C351 H263 109.5 .
C349 C352 H264 109.5 .
C349 C352 H265 109.5 .
H264 C352 H265 109.5 .
C349 C352 H266 109.5 .
H264 C352 H266 109.5 .
H265 C352 H266 109.5 .
N26 Pd13 O39 93.0(3) .
N26 Pd13 O37 176.2(2) .
O39 Pd13 O37 88.4(2) .
N26 Pd13 N25 84.0(3) .
O39 Pd13 N25 174.3(2) .
O37 Pd13 N25 94.3(2) .
N26 Pd13 Pd12 88.33(18) .
O39 Pd13 Pd12 92.95(15) .
O37 Pd13 Pd12 88.07(14) .
N25 Pd13 Pd12 82.20(18) .
O41 Pd14 N27 176.3(2) .
O41 Pd14 O40 89.2(2) .
N27 Pd14 O40 92.8(2) .
O41 Pd14 N28 93.2(3) .
N27 Pd14 N28 84.6(3) .
O40 Pd14 N28 175.5(3) .
O41 Pd14 Pd15 83.89(15) .
N27 Pd14 Pd15 92.88(18) .
O40 Pd14 Pd15 94.25(14) .
N28 Pd14 Pd15 82.27(18) .
O37 C353 C354 125.9(7) .
O37 C353 C358 112.8(6) .
C354 C353 C358 121.2(6) .
C355 C354 C353 118.5(7) .
C355 C354 C364 116.8(7) .
C353 C354 C364 124.7(7) .
C354 C355 C356 124.1(7) .
C354 C355 H267 117.9 .
C356 C355 H267 117.9 .
C357 C356 C355 116.0(7) .
C357 C356 C360 123.0(8) .
C355 C356 C360 120.7(7) .
C356 C357 C358 121.9(7) .
C356 C357 H268 119.0 .
C358 C357 H268 119.0 .
C353 C358 C359 123.4(7) .
C353 C358 C357 118.1(7) .
C359 C358 C357 118.5(7) .
C353 O37 Pd13 123.1(4) .
O38 C359 C358 125.7(7) .
O38 C359 H269 117.1 .
C358 C359 H269 117.1 .
C363 C360 C356 111.4(7) .
C363 C360 C362 108.1(7) .
C356 C360 C362 109.7(7) .
C363 C360 C361 107.9(8) .
C356 C360 C361 111.6(7) .
C362 C360 C361 108.1(8) .
C360 C361 H270 109.5 .
C360 C361 H271 109.5 .
H270 C361 H271 109.5 .
C360 C361 H272 109.5 .
H270 C361 H272 109.5 .
H271 C361 H272 109.5 .
C360 C362 H273 109.5 .
C360 C362 H274 109.5 .
H273 C362 H274 109.5 .
C360 C362 H275 109.5 .
H273 C362 H275 109.5 .
H274 C362 H275 109.5 .
C360 C363 H276 109.5 .
C360 C363 H277 109.5 .
H276 C363 H277 109.5 .
C360 C363 H278 109.5 .
H276 C363 H278 109.5 .
H277 C363 H278 109.5 .
C364 N25 C368 123.0(6) .
C364 N25 Pd13 125.0(5) .
C368 N25 Pd13 111.6(5) .
N25 C364 C365 116.8(7) .
N25 C364 C354 123.2(6) .
C365 C364 C354 120.0(6) .
C366 C365 C364 121.5(7) .
C366 C365 H279 119.3 .
C364 C365 H279 119.3 .
C365 C366 C367 119.6(7) .
C365 C366 H280 120.2 .
C367 C366 H280 120.2 .
C368 C367 C366 117.7(8) .
C368 C367 H281 121.2 .
C366 C367 H281 121.2 .
N25 C368 C367 121.4(7) .
N25 C368 C369 116.7(7) .
C367 C368 C369 121.9(7) .
C373 N26 C369 120.4(7) .
C373 N26 Pd13 127.1(6) .
C369 N26 Pd13 112.3(5) .
C370 C369 N26 120.6(8) .
C370 C369 C368 125.7(8) .
N26 C369 C368 113.7(7) .
C369 C370 C371 119.9(9) .
C369 C370 H282 120.0 .
C371 C370 H282 120.0 .
C370 C371 C372 119.2(9) .
C370 C371 H283 120.4 .
C372 C371 H283 120.4 .
C371 C372 C373 121.0(9) .
C371 C372 H284 119.5 .
C373 C372 H284 119.5 .
N26 C373 C372 118.1(8) .
N26 C373 C376 118.8(8) .
C372 C373 C376 123.1(8) .
C375 C374 C383 121.8(9) .
C375 C374 C384 118.5(7) .
C383 C374 C384 119.6(8) .
O39 C375 C374 116.8(8) .
O39 C375 C376 124.4(7) .
C374 C375 C376 118.8(7) .
C377 C376 C375 118.8(8) .
C377 C376 C373 117.3(9) .
C375 C376 C373 123.9(7) .
C378 C377 C376 122.9(10) .
C378 C377 H285 118.6 .
C376 C377 H285 118.6 .
C377 C378 C379 122.7(10) .
C377 C378 C383 120.0(8) .
C379 C378 C383 117.1(9) .
C380 C379 C378 122.9(11) .
C380 C379 H286 118.5 .
C378 C379 H286 118.5 .
C379 C380 C381 119.6(9) .
C379 C380 H287 120.2 .
C381 C380 H287 120.2 .
C380 C381 C382 122.5(10) .
C380 C381 H288 118.8 .
C382 C381 H288 118.8 .
C381 C382 C383 118.7(11) .
C381 C382 H289 120.7 .
C383 C382 H289 120.7 .
C374 C383 C382 123.5(10) .
C374 C383 C378 117.6(8) .
C382 C383 C378 119.0(8) .
C375 O39 Pd13 120.5(5) .
C393 C384 C385 120.1(9) .
C393 C384 C374 122.5(8) .
C385 C384 C374 117.0(7) .
O40 C385 C384 117.4(8) .
O40 C385 C386 124.1(7) .
C384 C385 C386 118.4(7) .
C387 C386 C385 119.4(7) .
C387 C386 C394 117.1(8) .
C385 C386 C394 123.5(7) .
C386 C387 C388 122.0(9) .
C386 C387 H290 119.0 .
C388 C387 H290 119.0 .
C387 C388 C389 120.9(9) .
C387 C388 C393 118.8(8) .
C389 C388 C393 120.3(9) .
C390 C389 C388 119.8(11) .
C390 C389 H291 120.1 .
C388 C389 H291 120.1 .
C391 C390 C389 119.8(10) .
C391 C390 H292 120.1 .
C389 C390 H292 120.1 .
C390 C391 C392 124.4(10) .
C390 C391 H293 117.8 .
C392 C391 H293 117.8 .
C391 C392 C393 117.1(11) .
C391 C392 H294 121.5 .
C393 C392 H294 121.5 .
C384 C393 C388 121.0(8) .
C384 C393 C392 120.6(10) .
C388 C393 C392 118.3(8) .
C385 O40 Pd14 121.2(5) .
C394 N27 C398 121.3(8) .
C394 N27 Pd14 125.9(6) .
C398 N27 Pd14 112.5(6) .
N27 C394 C395 118.2(8) .
N27 C394 C386 121.3(8) .
C395 C394 C386 120.5(7) .
C396 C395 C394 119.3(9) .
C396 C395 H295 120.4 .
C394 C395 H295 120.4 .
C397 C396 C395 120.5(10) .
C397 C396 H296 119.8 .
C395 C396 H296 119.8 .
C398 C397 C396 119.1(9) .
C398 C397 H297 120.4 .
C396 C397 H297 120.4 .
C397 C398 N27 121.2(8) .
C397 C398 C399 125.4(8) .
N27 C398 C399 113.4(8) .
C403 N28 C399 122.9(7) .
C403 N28 Pd14 127.1(6) .
C399 N28 Pd14 109.9(5) .
N28 C399 C400 120.2(8) .
N28 C399 C398 118.3(7) .
C400 C399 C398 121.6(8) .
C399 C400 C401 116.3(9) .
C399 C400 H298 121.9 .
C401 C400 H298 121.9 .
C402 C401 C400 121.5(8) .
C402 C401 H299 119.2 .
C400 C401 H299 119.2 .
C401 C402 C403 120.0(9) .
C401 C402 H300 120.0 .
C403 C402 H300 120.0 .
N28 C403 C402 118.7(9) .
N28 C403 C405 122.2(8) .
C402 C403 C405 119.0(8) .
O41 C404 C409 118.5(7) .
O41 C404 C405 126.1(8) .
C409 C404 C405 115.4(7) .
C406 C405 C404 118.1(9) .
C406 C405 C403 117.8(8) .
C404 C405 C403 124.0(7) .
C407 C406 C405 126.7(9) .
C407 C406 H301 116.6 .
C405 C406 H301 116.6 .
C406 C407 C408 115.1(8) .
C406 C407 C411 123.4(10) .
C408 C407 C411 121.4(9) .
C409 C408 C407 119.6(9) .
C409 C408 H302 120.2 .
C407 C408 H302 120.2 .
C408 C409 C404 125.0(9) .
C408 C409 C410 117.4(9) .
C404 C409 C410 117.7(7) .
C404 O41 Pd14 124.4(5) .
O42 C410 C409 126.3(9) .
O42 C410 H303 116.8 .
C409 C410 H303 116.8 .
C413 C411 C414 110.5(11) .
C413 C411 C407 107.5(8) .
C414 C411 C407 110.5(9) .
C413 C411 C412 108.6(10) .
C414 C411 C412 107.3(10) .
C407 C411 C412 112.4(10) .
C411 C412 H304 109.5 .
C411 C412 H305 109.5 .
H304 C412 H305 109.5 .
C411 C412 H306 109.5 .
H304 C412 H306 109.5 .
H305 C412 H306 109.5 .
C411 C413 H307 109.5 .
C411 C413 H308 109.5 .
H307 C413 H308 109.5 .
C411 C413 H309 109.5 .
H307 C413 H309 109.5 .
H308 C413 H309 109.5 .
C411 C414 H310 109.5 .
C411 C414 H311 109.5 .
H310 C414 H311 109.5 .
C411 C414 H312 109.5 .
H310 C414 H312 109.5 .
H311 C414 H312 109.5 .
N30 Pd15 O45 92.5(3) .
N30 Pd15 N29 84.7(3) .
O45 Pd15 N29 175.2(2) .
N30 Pd15 O43 177.0(2) .
O45 Pd15 O43 88.1(2) .
N29 Pd15 O43 94.5(2) .
N30 Pd15 Pd14 87.62(17) .
O45 Pd15 Pd14 91.91(15) .
N29 Pd15 Pd14 84.03(17) .
O43 Pd15 Pd14 89.38(16) .
N31 Pd16 N32 83.9(3) .
N31 Pd16 O46 92.5(3) .
N32 Pd16 O46 174.2(2) .
N31 Pd16 O47 176.2(2) .
N32 Pd16 O47 95.3(2) .
O46 Pd16 O47 88.1(2) .
N31 Pd16 Pd1 90.04(16) 1_654
N32 Pd16 Pd1 83.41(15) 1_654
O46 Pd16 Pd1 92.12(16) 1_654
O47 Pd16 Pd1 86.20(14) 1_654
O43 C415 C416 131.1(7) .
O43 C415 C420 111.8(7) .
C416 C415 C420 117.1(7) .
C417 C416 C415 120.5(7) .
C417 C416 C426 116.7(7) .
C415 C416 C426 122.7(7) .
C416 C417 C418 124.1(8) .
C416 C417 H313 118.0 .
C418 C417 H313 118.0 .
C419 C418 C417 115.1(8) .
C419 C418 C422 124.0(9) .
C417 C418 C422 120.7(9) .
C420 C419 C418 122.7(8) .
C420 C419 H314 118.7 .
C418 C419 H314 118.7 .
C419 C420 C415 120.4(8) .
C419 C420 C421 118.8(8) .
C415 C420 C421 120.5(8) .
C415 O43 Pd15 121.0(5) .
O44 C421 C420 124.7(9) .
O44 C421 H315 117.6 .
C420 C421 H315 117.6 .
C424 C422 C418 109.3(8) .
C424 C422 C425 109.8(10) .
C418 C422 C425 111.0(8) .
C424 C422 C423 110.8(10) .
C418 C422 C423 110.7(9) .
C425 C422 C423 105.1(9) .
C422 C423 H316 109.5 .
C422 C423 H317 109.5 .
H316 C423 H317 109.5 .
C422 C423 H318 109.5 .
H316 C423 H318 109.5 .
H317 C423 H318 109.5 .
C422 C424 H319 109.5 .
C422 C424 H320 109.5 .
H319 C424 H320 109.5 .
C422 C424 H321 109.5 .
H319 C424 H321 109.5 .
H320 C424 H321 109.5 .
C422 C425 H322 109.5 .
C422 C425 H323 109.5 .
H322 C425 H323 109.5 .
C422 C425 H324 109.5 .
H322 C425 H324 109.5 .
H323 C425 H324 109.5 .
C426 N29 C430 121.7(7) .
C426 N29 Pd15 126.5(5) .
C430 N29 Pd15 111.4(6) .
N29 C426 C427 118.5(8) .
N29 C426 C416 120.8(7) .
C427 C426 C416 120.7(7) .
C428 C427 C426 119.4(9) .
C428 C427 H325 120.3 .
C426 C427 H325 120.3 .
C429 C428 C427 120.6(9) .
C429 C428 H326 119.7 .
C427 C428 H326 119.7 .
C430 C429 C428 119.4(8) .
C430 C429 H327 120.3 .
C428 C429 H327 120.3 .
C429 C430 N29 120.0(8) .
C429 C430 C431 124.6(8) .
N29 C430 C431 115.2(8) .
C435 N30 C431 120.4(7) .
C435 N30 Pd15 127.6(6) .
C431 N30 Pd15 111.2(5) .
C432 C431 N30 118.1(9) .
C432 C431 C430 126.2(9) .
N30 C431 C430 115.6(7) .
C433 C432 C431 120.5(9) .
C433 C432 H328 119.7 .
C431 C432 H328 119.7 .
C432 C433 C434 120.7(9) .
C432 C433 H329 119.7 .
C434 C433 H329 119.7 .
C435 C434 C433 119.6(10) .
C435 C434 H330 120.2 .
C433 C434 H330 120.2 .
N30 C435 C434 120.6(9) .
N30 C435 C438 118.3(7) .
C434 C435 C438 121.1(8) .
C437 C436 C445 120.8(8) .
C437 C436 C446 117.1(7) .
C445 C436 C446 122.0(7) .
O45 C437 C436 119.4(7) .
O45 C437 C438 121.4(8) .
C436 C437 C438 119.1(7) .
C439 C438 C437 118.2(8) .
C439 C438 C435 116.6(8) .
C437 C438 C435 125.1(7) .
C438 C439 C440 122.6(8) .
C438 C439 H331 118.7 .
C440 C439 H331 118.7 .
C439 C440 C445 119.0(8) .
C439 C440 C441 123.3(9) .
C445 C440 C441 117.8(9) .
C442 C441 C440 121.9(10) .
C442 C441 H332 119.0 .
C440 C441 H332 119.0 .
C441 C442 C443 122.1(10) .
C441 C442 H333 119.0 .
C443 C442 H333 119.0 .
C444 C443 C442 119.0(10) .
C444 C443 H334 120.5 .
C442 C443 H334 120.5 .
C443 C444 C445 120.5(9) .
C443 C444 H335 119.7 .
C445 C444 H335 119.7 .
C440 C445 C436 120.3(8) .
C440 C445 C444 118.6(8) .
C436 C445 C444 121.1(8) .
C437 O45 Pd15 122.5(5) .
C447 C446 C455 120.4(7) .
C447 C446 C436 118.1(7) .
C455 C446 C436 121.4(7) .
O46 C447 C446 117.7(7) .
O46 C447 C448 123.8(7) .
C446 C447 C448 118.5(7) .
C449 C448 C447 120.1(8) .
C449 C448 C456 115.2(8) .
C447 C448 C456 124.6(7) .
C450 C449 C448 121.0(8) .
C450 C449 H336 119.5 .
C448 C449 H336 119.5 .
C449 C450 C455 119.4(8) .
C449 C450 C451 120.2(9) .
C455 C450 C451 120.4(8) .
C452 C451 C450 120.0(10) .
C452 C451 H337 120.0 .
C450 C451 H337 120.0 .
C451 C452 C453 119.8(9) .
C451 C452 H338 120.1 .
C453 C452 H338 120.1 .
C454 C453 C452 122.9(9) .
C454 C453 H339 118.6 .
C452 C453 H339 118.6 .
C453 C454 C455 118.4(9) .
C453 C454 H340 120.8 .
C455 C454 H340 120.8 .
C450 C455 C446 120.3(8) .
C450 C455 C454 118.3(8) .
C446 C455 C454 121.2(8) .
C447 O46 Pd16 120.1(5) .
C456 N31 C460 121.0(6) .
C456 N31 Pd16 126.5(5) .
C460 N31 Pd16 112.0(5) .
N31 C456 C457 119.2(8) .
N31 C456 C448 118.7(7) .
C457 C456 C448 122.1(8) .
C458 C457 C456 120.1(8) .
C458 C457 H341 120.0 .
C456 C457 H341 120.0 .
C459 C458 C457 119.2(8) .
C459 C458 H342 120.4 .
C457 C458 H342 120.4 .
C458 C459 C460 121.3(9) .
C458 C459 H343 119.3 .
C460 C459 H343 119.3 .
N31 C460 C459 118.5(8) .
N31 C460 C461 115.6(6) .
C459 C460 C461 125.9(8) .
C465 N32 C461 123.0(7) .
C465 N32 Pd16 124.5(5) .
C461 N32 Pd16 112.3(5) .
C462 C461 N32 121.4(8) .
C462 C461 C460 123.9(7) .
N32 C461 C460 114.7(7) .
C461 C462 C463 119.4(7) .
C461 C462 H344 120.3 .
C463 C462 H344 120.3 .
C462 C463 C464 119.6(7) .
C462 C463 H345 120.2 .
C464 C463 H345 120.2 .
C463 C464 C465 121.8(8) .
C463 C464 H346 119.1 .
C465 C464 H346 119.1 .
N32 C465 C467 123.8(7) .
N32 C465 C464 114.8(7) .
C467 C465 C464 121.3(7) .
O47 C466 C471 115.5(7) .
O47 C466 C467 125.9(7) .
C471 C466 C467 118.6(7) .
C468 C467 C465 121.2(8) .
C468 C467 C466 113.6(7) .
C465 C467 C466 125.2(7) .
C469 C468 C467 129.0(9) .
C469 C468 H347 115.5 .
C467 C468 H347 115.5 .
C468 C469 C470 115.6(8) .
C468 C469 C473 122.5(9) .
C470 C469 C473 121.8(8) .
C469 C470 C471 121.9(8) .
C469 C470 H348 119.0 .
C471 C470 H348 119.0 .
C470 C471 C466 121.1(8) .
C470 C471 C472 121.0(7) .
C466 C471 C472 117.9(7) .
C466 O47 Pd16 121.9(5) .
O48 C472 C471 123.9(8) .
O48 C472 H349 118.1 .
C471 C472 H349 118.1 .
C474 C473 C469 114.4(9) .
C474 C473 C476 106.9(9) .
C469 C473 C476 111.0(8) .
C474 C473 C475 108.6(8) .
C469 C473 C475 108.4(8) .
C476 C473 C475 107.2(9) .
C473 C474 H350 109.5 .
C473 C474 H351 109.5 .
H350 C474 H351 109.5 .
C473 C474 H352 109.5 .
H350 C474 H352 109.5 .
H351 C474 H352 109.5 .
C473 C475 H353 109.5 .
C473 C475 H354 109.5 .
H353 C475 H354 109.5 .
C473 C475 H355 109.5 .
H353 C475 H355 109.5 .
H354 C475 H355 109.5 .
C473 C476 H356 109.5 .
C473 C476 H357 109.5 .
H356 C476 H357 109.5 .
C473 C476 H358 109.5 .
H356 C476 H358 109.5 .
H357 C476 H358 109.5 .
O49 C477 N33 122.9(18) .
O49 C477 H359 118.6 .
N33 C477 H359 118.6 .
C478 N33 C477 124.4(15) .
C478 N33 C479 115.9(15) .
C477 N33 C479 119.3(15) .
N33 C478 H360 109.5 .
N33 C478 H361 109.5 .
H360 C478 H361 109.5 .
N33 C478 H362 109.5 .
H360 C478 H362 109.5 .
H361 C478 H362 109.5 .
N33 C479 H363 109.5 .
N33 C479 H364 109.5 .
H363 C479 H364 109.5 .
N33 C479 H365 109.5 .
H363 C479 H365 109.5 .
H364 C479 H365 109.5 .
O50 C480 N34 123.3(13) .
O50 C480 H366 118.4 .
N34 C480 H366 118.4 .
C480 N34 C482 118.9(13) .
C480 N34 C481 120.7(12) .
C482 N34 C481 120.4(12) .
N34 C481 H367 109.5 .
N34 C481 H368 109.5 .
H367 C481 H368 109.5 .
N34 C481 H369 109.5 .
H367 C481 H369 109.5 .
H368 C481 H369 109.5 .
N34 C482 H370 109.5 .
N34 C482 H371 109.5 .
H370 C482 H371 109.5 .
N34 C482 H372 109.5 .
H370 C482 H372 109.5 .
H371 C482 H372 109.5 .
O51 C483 N35 124.6(15) .
O51 C483 H373 117.7 .
N35 C483 H373 117.7 .
C483 N35 C484 120.7(14) .
C483 N35 C485 117.0(14) .
C484 N35 C485 122.2(14) .
N35 C484 H374 109.5 .
N35 C484 H375 109.5 .
H374 C484 H375 109.5 .
N35 C484 H376 109.5 .
H374 C484 H376 109.5 .
H375 C484 H376 109.5 .
N35 C485 H377 109.5 .
N35 C485 H378 109.5 .
H377 C485 H378 109.5 .
N35 C485 H379 109.5 .
H377 C485 H379 109.5 .
H378 C485 H379 109.5 .
O52 C486 N36 123(2) .
O52 C486 H380 118.7 .
N36 C486 H380 118.7 .
C488 N36 C486 122(2) .
C488 N36 C487 114(2) .
C486 N36 C487 123(2) .
N36 C487 H381 109.5 .
N36 C487 H382 109.5 .
H381 C487 H382 109.5 .
N36 C487 H383 109.5 .
H381 C487 H383 109.5 .
H382 C487 H383 109.5 .
N36 C488 H384 109.5 .
N36 C488 H385 109.5 .
H384 C488 H385 109.5 .
N36 C488 H386 109.5 .
H384 C488 H386 109.5 .
H385 C488 H386 109.5 .
O53 C489 N37 128(2) .
O53 C489 H387 116.0 .
N37 C489 H387 116.0 .
C489 N37 C490 119(2) .
C489 N37 C491 118.9(19) .
C490 N37 C491 122.4(18) .
N37 C490 H388 109.5 .
N37 C490 H389 109.5 .
H388 C490 H389 109.5 .
N37 C490 H390 109.5 .
H388 C490 H390 109.5 .
H389 C490 H390 109.5 .
N37 C491 H391 109.5 .
N37 C491 H392 109.5 .
H391 C491 H392 109.5 .
N37 C491 H393 109.5 .
H391 C491 H393 109.5 .
H392 C491 H393 109.5 .
N38 C492 O54 127(2) .
N38 C492 H394 116.6 .
O54 C492 H394 116.6 .
C492 N38 C494 121(2) .
C492 N38 C493 115.2(18) .
C494 N38 C493 123.3(19) .
N38 C493 H395 109.5 .
N38 C493 H396 109.5 .
H395 C493 H396 109.5 .
N38 C493 H397 109.5 .
H395 C493 H397 109.5 .
H396 C493 H397 109.5 .
N38 C494 H398 109.5 .
N38 C494 H399 109.5 .
H398 C494 H399 109.5 .
N38 C494 H400 109.5 .
H398 C494 H400 109.5 .
H399 C494 H400 109.5 .
O55 C495 N39 113(2) .
O55 C495 H401 123.5 .
N39 C495 H401 123.5 .
C496 N39 C495 130(2) .
C496 N39 C497 118(2) .
C495 N39 C497 111.7(19) .
N39 C496 H402 109.5 .
N39 C496 H403 109.5 .
H402 C496 H403 109.5 .
N39 C496 H404 109.5 .
H402 C496 H404 109.5 .
H403 C496 H404 109.5 .
N39 C497 H405 109.5 .
N39 C497 H406 109.5 .
H405 C497 H406 109.5 .
N39 C497 H407 109.5 .
H405 C497 H407 109.5 .
H406 C497 H407 109.5 .
O56 C498 N40 138(2) .
O56 C498 H408 110.8 .
N40 C498 H408 110.8 .
C498 N40 C500 136(2) .
C498 N40 C499 113.1(14) .
C500 N40 C499 109.2(15) .
N40 C499 H409 109.5 .
N40 C499 H410 109.5 .
H409 C499 H410 109.5 .
N40 C499 H411 109.5 .
H409 C499 H411 109.5 .
H410 C499 H411 109.5 .
N40 C500 H412 109.5 .
N40 C500 H413 109.5 .
H412 C500 H413 109.5 .
N40 C500 H414 109.5 .
H412 C500 H414 109.5 .
H413 C500 H414 109.5 .
O57 C501 N41 96.5(13) .
O57 C501 H415 131.8 .
N41 C501 H415 131.8 .
C502 N41 C503 120.4(16) .
C502 N41 C501 123.8(16) .
C503 N41 C501 115.8(14) .
N41 C502 H416 109.5 .
N41 C502 H417 109.5 .
H416 C502 H417 109.5 .
N41 C502 H418 109.5 .
H416 C502 H418 109.5 .
H417 C502 H418 109.5 .
N41 C503 H419 109.5 .
N41 C503 H420 109.5 .
H419 C503 H420 109.5 .
N41 C503 H421 109.5 .
H419 C503 H421 109.5 .
H420 C503 H421 109.5 .
O58 C504 N42 129(2) .
O58 C504 H422 115.7 .
N42 C504 H422 115.7 .
C504 N42 C505 124.6(15) .
C504 N42 C506 123.2(16) .
C505 N42 C506 112.0(14) .
N42 C505 H423 109.5 .
N42 C505 H424 109.5 .
H423 C505 H424 109.5 .
N42 C505 H425 109.5 .
H423 C505 H425 109.5 .
H424 C505 H425 109.5 .
N42 C506 H426 109.5 .
N42 C506 H427 109.5 .
H426 C506 H427 109.5 .
N42 C506 H428 109.5 .
H426 C506 H428 109.5 .
H427 C506 H428 109.5 .
O59 C507 N43 128.4(17) .
O59 C507 H429 115.8 .
N43 C507 H429 115.8 .
C507 N43 C509 119.8(14) .
C507 N43 C508 121.7(13) .
C509 N43 C508 116.6(13) .
N43 C508 H430 109.5 .
N43 C508 H431 109.5 .
H430 C508 H431 109.5 .
N43 C508 H432 109.5 .
H430 C508 H432 109.5 .
H431 C508 H432 109.5 .
N43 C509 H433 109.5 .
N43 C509 H434 109.5 .
H433 C509 H434 109.5 .
N43 C509 H435 109.5 .
H433 C509 H435 109.5 .
H434 C509 H435 109.5 .
O60 C510 N44 119.5(16) .
O60 C510 H436 120.3 .
N44 C510 H436 120.3 .
C510 N44 C511 122.5(14) .
C510 N44 C512 119.3(14) .
C511 N44 C512 118.1(14) .
N44 C511 H437 109.5 .
N44 C511 H438 109.5 .
H437 C511 H438 109.5 .
N44 C511 H439 109.5 .
H437 C511 H439 109.5 .
H438 C511 H439 109.5 .
N44 C512 H440 109.5 .
N44 C512 H441 109.5 .
H440 C512 H441 109.5 .
N44 C512 H442 109.5 .
H440 C512 H442 109.5 .
H441 C512 H442 109.5 .
O61 C513 N45 122(2) .
O61 C513 H443 119.1 .
N45 C513 H443 119.1 .
C513 N45 C514 122.0(17) .
C513 N45 C515 124.3(18) .
C514 N45 C515 113.6(16) .
N45 C514 H444 109.5 .
N45 C514 H445 109.5 .
H444 C514 H445 109.5 .
N45 C514 H446 109.5 .
H444 C514 H446 109.5 .
H445 C514 H446 109.5 .
N45 C515 H447 109.5 .
N45 C515 H448 109.5 .
H447 C515 H448 109.5 .
N45 C515 H449 109.5 .
H447 C515 H449 109.5 .
H448 C515 H449 109.5 .
O62 C516 N46 124(2) .
O62 C516 H450 117.8 .
N46 C516 H450 117.8 .
C516 N46 C518 123.4(16) .
C516 N46 C517 119.3(14) .
C518 N46 C517 117.2(15) .
N46 C517 H451 109.5 .
N46 C517 H452 109.5 .
H451 C517 H452 109.5 .
N46 C517 H453 109.5 .
H451 C517 H453 109.5 .
H452 C517 H453 109.5 .
N46 C518 H454 109.5 .
N46 C518 H455 109.5 .
H454 C518 H455 109.5 .
N46 C518 H456 109.5 .
H454 C518 H456 109.5 .
H455 C518 H456 109.5 .
O63 C519 N47 126(2) .
O63 C519 H457 117.0 .
N47 C519 H457 117.0 .
C519 N47 C521 123.2(16) .
C519 N47 C520 120.5(14) .
C521 N47 C520 115.6(15) .
N47 C520 H458 109.5 .
N47 C520 H459 109.5 .
H458 C520 H459 109.5 .
N47 C520 H460 109.5 .
H458 C520 H460 109.5 .
H459 C520 H460 109.5 .
N47 C521 H461 109.5 .
N47 C521 H462 109.5 .
H461 C521 H462 109.5 .
N47 C521 H463 109.5 .
H461 C521 H463 109.5 .
H462 C521 H463 109.5 .
O64 C522 N48 123.4(17) .
O64 C522 H464 118.3 .
N48 C522 H464 118.3 .
C522 N48 C523 122.4(13) .
C522 N48 C524 121.1(14) .
C523 N48 C524 116.4(13) .
N48 C523 H465 109.5 .
N48 C523 H466 109.5 .
H465 C523 H466 109.5 .
N48 C523 H467 109.5 .
H465 C523 H467 109.5 .
H466 C523 H467 109.5 .
N48 C524 H468 109.5 .
N48 C524 H469 109.5 .
H468 C524 H469 109.5 .
N48 C524 H470 109.5 .
H468 C524 H470 109.5 .
H469 C524 H470 109.5 .
O65 C525 N49 126.4(18) .
O65 C525 H471 116.8 .
N49 C525 H471 116.8 .
C525 N49 C527 123.1(15) .
C525 N49 C526 122.1(14) .
C527 N49 C526 114.7(13) .
N49 C526 H472 109.5 .
N49 C526 H473 109.5 .
H472 C526 H473 109.5 .
N49 C526 H474 109.5 .
H472 C526 H474 109.5 .
H473 C526 H474 109.5 .
N49 C527 H475 109.5 .
N49 C527 H476 109.5 .
H475 C527 H476 109.5 .
N49 C527 H477 109.5 .
H475 C527 H477 109.5 .
H476 C527 H477 109.5 .
O66 C528 N50 123.5(19) .
O66 C528 H478 118.2 .
N50 C528 H478 118.2 .
C528 N50 C529 125.0(15) .
C528 N50 C530 116.9(15) .
C529 N50 C530 117.2(14) .
N50 C529 H479 109.5 .
N50 C529 H480 109.5 .
H479 C529 H480 109.5 .
N50 C529 H481 109.5 .
H479 C529 H481 109.5 .
H480 C529 H481 109.5 .
N50 C530 H482 109.5 .
N50 C530 H483 109.5 .
H482 C530 H483 109.5 .
N50 C530 H484 109.5 .
H482 C530 H484 109.5 .
H483 C530 H484 109.5 .
O67 C531 N51 148(3) .
O67 C531 H485 105.9 .
N51 C531 H485 105.9 .
C531 N51 C532 127.1(17) .
C531 N51 C533 122.8(17) .
C532 N51 C533 110.0(14) .
N51 C532 H486 109.5 .
N51 C532 H487 109.5 .
H486 C532 H487 109.5 .
N51 C532 H488 109.5 .
H486 C532 H488 109.5 .
H487 C532 H488 109.5 .
N51 C533 H489 109.5 .
N51 C533 H490 109.5 .
H489 C533 H490 109.5 .
N51 C533 H491 109.5 .
H489 C533 H491 109.5 .
H490 C533 H491 109.5 .
O68 C534 N52 122.2(16) .
O68 C534 H492 118.9 .
N52 C534 H492 118.9 .
C534 N52 C535 120.0(13) .
C534 N52 C536 122.2(14) .
C535 N52 C536 117.8(13) .
N52 C535 H493 109.5 .
N52 C535 H494 109.5 .
H493 C535 H494 109.5 .
N52 C535 H495 109.5 .
H493 C535 H495 109.5 .
H494 C535 H495 109.5 .
N52 C536 H496 109.5 .
N52 C536 H497 109.5 .
H496 C536 H497 109.5 .
N52 C536 H498 109.5 .
H496 C536 H498 109.5 .
H497 C536 H498 109.5 .
O69 C537 N53 111.9(15) .
O69 C537 H499 124.1 .
N53 C537 H499 124.1 .
C537 N53 C539 123.7(15) .
C537 N53 C538 116.2(13) .
C539 N53 C538 120.0(14) .
N53 C538 H500 109.5 .
N53 C538 H501 109.5 .
H500 C538 H501 109.5 .
N53 C538 H502 109.5 .
H500 C538 H502 109.5 .
H501 C538 H502 109.5 .
N53 C539 H503 109.5 .
N53 C539 H504 109.5 .
H503 C539 H504 109.5 .
N53 C539 H505 109.5 .
H503 C539 H505 109.5 .
H504 C539 H505 109.5 .
O70 C540 N54 127.5(19) .
O70 C540 H506 116.2 .
N54 C540 H506 116.3 .
C540 N54 C542 122.3(15) .
C540 N54 C541 120.3(14) .
C542 N54 C541 116.6(14) .
N54 C541 H507 109.5 .
N54 C541 H508 109.5 .
H507 C541 H508 109.5 .
N54 C541 H509 109.5 .
H507 C541 H509 109.5 .
H508 C541 H509 109.5 .
N54 C542 H510 109.5 .
N54 C542 H511 109.5 .
H510 C542 H511 109.5 .
N54 C542 H512 109.5 .
H510 C542 H512 109.5 .
H511 C542 H512 109.5 .
O71 C543 N55 129(2) .
O71 C543 H513 115.7 .
N55 C543 H513 115.7 .
C543 N55 C544 122.6(15) .
C543 N55 C545 122.1(16) .
C544 N55 C545 115.2(14) .
N55 C544 H514 109.5 .
N55 C544 H515 109.5 .
H514 C544 H515 109.5 .
N55 C544 H516 109.5 .
H514 C544 H516 109.5 .
H515 C544 H516 109.5 .
N55 C545 H517 109.5 .
N55 C545 H518 109.5 .
H517 C545 H518 109.5 .
N55 C545 H519 109.5 .
H517 C545 H519 109.5 .
H518 C545 H519 109.5 .
O72 C546 N56 120.9(18) .
O72 C546 H520 119.5 .
N56 C546 H520 119.5 .
C546 N56 C548 124.1(15) .
C546 N56 C547 119.8(14) .
C548 N56 C547 116.0(14) .
N56 C547 H521 109.5 .
N56 C547 H522 109.5 .
H521 C547 H522 109.5 .
N56 C547 H523 109.5 .
H521 C547 H523 109.5 .
H522 C547 H523 109.5 .
N56 C548 H524 109.5 .
N56 C548 H525 109.5 .
H524 C548 H525 109.5 .
N56 C548 H526 109.5 .
H524 C548 H526 109.5 .
H525 C548 H526 109.5 .
O73 C549 N57 115.9(19) .
O73 C549 H527 122.0 .
N57 C549 H527 122.0 .
C549 N57 C551 124.6(17) .
C549 N57 C550 118.3(15) .
C551 N57 C550 117.0(15) .
N57 C550 H528 109.5 .
N57 C550 H529 109.5 .
H528 C550 H529 109.5 .
N57 C550 H530 109.5 .
H528 C550 H530 109.5 .
H529 C550 H530 109.5 .
N57 C551 H531 109.5 .
N57 C551 H532 109.5 .
H531 C551 H532 109.5 .
N57 C551 H533 109.5 .
H531 C551 H533 109.5 .
H532 C551 H533 109.5 .
O74 C552 N58 121.2(15) .
O74 C552 H534 119.4 .
N58 C552 H534 119.4 .
C552 N58 C554 120.7(14) .
C552 N58 C553 120.1(13) .
C554 N58 C553 118.7(13) .
N58 C553 H535 109.5 .
N58 C553 H536 109.5 .
H535 C553 H536 109.5 .
N58 C553 H537 109.5 .
H535 C553 H537 109.5 .
H536 C553 H537 109.5 .
N58 C554 H538 109.5 .
N58 C554 H539 109.5 .
H538 C554 H539 109.5 .
N58 C554 H540 109.5 .
H538 C554 H540 109.5 .
H539 C554 H540 109.5 .
O75 C555 N59 129(2) .
O75 C555 H541 115.3 .
N59 C555 H541 115.3 .
C555 N59 C556 123.2(17) .
C555 N59 C557 119.1(16) .
C556 N59 C557 115.5(16) .
N59 C556 H542 109.5 .
N59 C556 H543 109.5 .
H542 C556 H543 109.5 .
N59 C556 H544 109.5 .
H542 C556 H544 109.5 .
H543 C556 H544 109.5 .
N59 C557 H545 109.5 .
N59 C557 H546 109.5 .
H545 C557 H546 109.5 .
N59 C557 H547 109.5 .
H545 C557 H547 109.5 .
H546 C557 H547 109.5 .
O76 C558 N60 136(3) .
O76 C558 H548 112.0 .
N60 C558 H548 112.0 .
C558 N60 C559 123.6(16) .
C558 N60 C560 121.4(17) .
C559 N60 C560 114.9(15) .
N60 C559 H549 109.5 .
N60 C559 H550 109.5 .
H549 C559 H550 109.5 .
N60 C559 H551 109.5 .
H549 C559 H551 109.5 .
H550 C559 H551 109.5 .
N60 C560 H552 109.5 .
N60 C560 H553 109.5 .
H552 C560 H553 109.5 .
N60 C560 H554 109.5 .
H552 C560 H554 109.5 .
H553 C560 H554 109.5 .
C561 O77 H635 93(8) .
O77 C561 N61 123(3) .
O77 C561 H555 118.4 .
N61 C561 H555 118.4 .
C561 N61 C562 123.0(17) .
C561 N61 C563 120.5(17) .
C562 N61 C563 116.5(17) .
N61 C562 H556 109.5 .
N61 C562 H557 109.5 .
H556 C562 H557 109.5 .
N61 C562 H558 109.5 .
H556 C562 H558 109.5 .
H557 C562 H558 109.5 .
N61 C563 H559 109.5 .
N61 C563 H560 109.5 .
H559 C563 H560 109.5 .
N61 C563 H561 109.5 .
H559 C563 H561 109.5 .
H560 C563 H561 109.5 .
O78 C564 N62 136(3) .
O78 C564 H562 112.0 .
N62 C564 H562 112.0 .
C564 N62 C565 125.6(17) .
C564 N62 C566 119.8(17) .
C565 N62 C566 114.4(16) .
N62 C565 H563 109.5 .
N62 C565 H564 109.5 .
H563 C565 H564 109.5 .
N62 C565 H565 109.5 .
H563 C565 H565 109.5 .
H564 C565 H565 109.5 .
N62 C566 H566 109.5 .
N62 C566 H567 109.5 .
H566 C566 H567 109.5 .
N62 C566 H568 109.5 .
H566 C566 H568 109.5 .
H567 C566 H568 109.5 .
O79 C567 N63 120(2) .
O79 C567 H569 120.1 .
N63 C567 H569 120.1 .
C567 N63 C569 122.6(17) .
C567 N63 C568 119.5(16) .
C569 N63 C568 117.8(16) .
N63 C568 H570 109.5 .
N63 C568 H571 109.5 .
H570 C568 H571 109.5 .
N63 C568 H572 109.5 .
H570 C568 H572 109.5 .
H571 C568 H572 109.5 .
N63 C569 H573 109.5 .
N63 C569 H574 109.5 .
H573 C569 H574 109.5 .
N63 C569 H575 109.5 .
H573 C569 H575 109.5 .
H574 C569 H575 109.5 .
O80 C570 N64 122(2) .
O80 C570 H576 118.8 .
N64 C570 H576 118.9 .
C570 N64 C572 122.2(17) .
C570 N64 C571 120.4(16) .
C572 N64 C571 117.2(16) .
N64 C571 H577 109.5 .
N64 C571 H578 109.5 .
H577 C571 H578 109.5 .
N64 C571 H579 109.5 .
H577 C571 H579 109.5 .
H578 C571 H579 109.5 .
N64 C572 H580 109.5 .
N64 C572 H581 109.5 .
H580 C572 H581 109.5 .
N64 C572 H582 109.5 .
H580 C572 H582 109.5 .
H581 C572 H582 109.5 .
O81 C573 N65 129(2) .
O81 C573 H583 115.3 .
N65 C573 H583 115.3 .
C573 N65 C574 124.8(16) .
C573 N65 C575 121.6(17) .
C574 N65 C575 113.6(15) .
N65 C574 H584 109.5 .
N65 C574 H585 109.5 .
H584 C574 H585 109.5 .
N65 C574 H586 109.5 .
H584 C574 H586 109.5 .
H585 C574 H586 109.5 .
N65 C575 H587 109.5 .
N65 C575 H588 109.5 .
H587 C575 H588 109.5 .
N65 C575 H589 109.5 .
H587 C575 H589 109.5 .
H588 C575 H589 109.5 .
O82 C576 N66 128(2) .
O82 C576 H590 116.1 .
N66 C576 H590 116.1 .
C576 N66 C578 119.4(16) .
C576 N66 C577 123.4(15) .
C578 N66 C577 117.0(15) .
N66 C577 H591 109.5 .
N66 C577 H592 109.5 .
H591 C577 H592 109.5 .
N66 C577 H593 109.5 .
H591 C577 H593 109.5 .
H592 C577 H593 109.5 .
N66 C578 H594 109.5 .
N66 C578 H595 109.5 .
H594 C578 H595 109.5 .
N66 C578 H596 109.5 .
H594 C578 H596 109.5 .
H595 C578 H596 109.5 .
O83 C579 N67 122(2) .
O83 C579 H597 119.1 .
N67 C579 H597 119.1 .
C579 N67 C581 123.1(17) .
C579 N67 C580 120.7(16) .
C581 N67 C580 116.1(16) .
N67 C580 H598 109.5 .
N67 C580 H599 109.5 .
H598 C580 H599 109.5 .
N67 C580 H600 109.5 .
H598 C580 H600 109.5 .
H599 C580 H600 109.5 .
N67 C581 H601 109.5 .
N67 C581 H602 109.5 .
H601 C581 H602 109.5 .
N67 C581 H603 109.5 .
H601 C581 H603 109.5 .
H602 C581 H603 109.5 .
C583 C582 H604 109.5 .
C583 C582 H605 109.5 .
H604 C582 H605 109.5 .
C583 C582 H606 109.5 .
H604 C582 H606 109.5 .
H605 C582 H606 109.5 .
C582 C583 O84 108.9(12) .
C582 C583 H607 109.9 .
O84 C583 H607 109.9 .
C582 C583 H608 109.9 .
O84 C583 H608 109.9 .
H607 C583 H608 108.3 .
C583 O84 C584 109.5(14) .
C585 C584 O84 108.3(17) .
C585 C584 H609 110.0 .
O84 C584 H609 110.0 .
C585 C584 H610 110.0 .
O84 C584 H610 110.0 .
H609 C584 H610 108.4 .
C584 C585 H611 109.5 .
C584 C585 H612 109.5 .
H611 C585 H612 109.5 .
C584 C585 H613 109.5 .
H611 C585 H613 109.5 .
H612 C585 H613 109.5 .
H614 O85 H615 140(10) .
H616 O86 H617 127(10) .
H618 O87 H619 98(10) .
H620 O88 H621 114(10) .
H622 O89 H623 109(10) .
H624 O90 H625 141(10) .
H626 O91 H627 107(10) .
H628 O92 H629 123(10) .
H630 O93 H631 110(10) .
H632 O94 H633 101(10) .
H634 O95 H635 101(3) .
H636 O96 H637 113(10) .
H638 O97 H639 99(3) .
H640 O98 H641 85(10) .
H642 O99 H643 102(3) .
H644 O100 H645 101(3) .
H646 O101 H647 102(2) .
H648 O102 H649 101(2) .
H650 O103 H651 126(10) .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pd1 O1 1.951(6) .
Pd1 O3 1.968(5) .
Pd1 N2 1.969(7) .
Pd1 N1 1.984(7) .
Pd1 Pd16 3.2317(7) 1_456
Pd2 O5 1.933(7) .
Pd2 N4 1.960(6) .
Pd2 N3 1.971(7) .
Pd2 O4 1.976(5) .
C1 O1 1.323(9) .
C1 C2 1.411(12) .
C1 C6 1.447(12) .
C2 C3 1.419(12) .
C2 C12 1.437(13) .
C3 C4 1.428(16) .
C3 H1 0.9500 .
C4 C5 1.353(14) .
C4 C8 1.574(12) .
C5 C6 1.399(11) .
C5 H2 0.9500 .
C6 C7 1.459(12) .
C7 O2 1.217(11) .
C7 H3 0.9500 .
C8 C9 1.46(2) .
C8 C11 1.516(17) .
C8 C10 1.583(15) .
C9 H4 0.9800 .
C9 H5 0.9800 .
C9 H6 0.9800 .
C10 H7 0.9800 .
C10 H8 0.9800 .
C10 H9 0.9800 .
C11 H10 0.9800 .
C11 H11 0.9800 .
C11 H12 0.9800 .
N1 C12 1.360(12) .
N1 C16 1.366(12) .
C12 C13 1.408(11) .
C13 C14 1.400(17) .
C13 H13 0.9500 .
C14 C15 1.357(18) .
C14 H14 0.9500 .
C15 C16 1.381(14) .
C15 H15 0.9500 .
C16 C17 1.434(15) .
N2 C17 1.328(12) .
N2 C21 1.365(12) .
C17 C18 1.380(15) .
C18 C19 1.43(2) .
C18 H16 0.9500 .
C19 C20 1.376(19) .
C19 H17 0.9500 .
C20 C21 1.427(14) .
C20 H18 0.9500 .
C21 C24 1.478(13) .
C22 C23 1.402(12) .
C22 C31 1.433(11) .
C22 C32 1.459(13) .
C23 O3 1.349(9) .
C23 C24 1.430(12) .
C24 C25 1.386(12) .
C25 C26 1.377(16) .
C25 H19 0.9500 .
C26 C31 1.416(16) .
C26 C27 1.423(12) .
C27 C28 1.306(19) .
C27 H20 0.9500 .
C28 C29 1.44(2) .
C28 H21 0.9500 .
C29 C30 1.387(13) .
C29 H22 0.9500 .
C30 C31 1.413(14) .
C30 H23 0.9500 .
C32 C41 1.424(12) .
C32 C33 1.428(10) .
C33 O4 1.298(9) .
C33 C34 1.457(12) .
C34 C35 1.388(11) .
C34 C42 1.461(11) .
C35 C36 1.404(11) .
C35 H24 0.9500 .
C36 C41 1.390(13) .
C36 C37 1.395(12) .
C37 C38 1.349(14) .
C37 H25 0.9500 .
C38 C39 1.409(17) .
C38 H26 0.9500 .
C39 C40 1.336(14) .
C39 H27 0.9500 .
C40 C41 1.409(12) .
C40 H28 0.9500 .
N3 C42 1.343(10) .
N3 C46 1.386(10) .
C42 C43 1.391(12) .
C43 C44 1.378(13) .
C43 H29 0.9500 .
C44 C45 1.394(14) .
C44 H30 0.9500 .
C45 C46 1.345(13) .
C45 H31 0.9500 .
C46 C47 1.463(12) .
N4 C47 1.332(10) .
N4 C51 1.366(10) .
C47 C48 1.395(11) .
C48 C49 1.362(13) .
C48 H32 0.9500 .
C49 C50 1.380(13) .
C49 H33 0.9500 .
C50 C51 1.408(10) .
C50 H34 0.9500 .
C51 C53 1.488(12) .
C52 O5 1.318(9) .
C52 C53 1.431(10) .
C52 C57 1.450(12) .
C53 C54 1.398(11) .
C54 C55 1.384(14) .
C54 H35 0.9500 .
C55 C56 1.378(14) .
C55 C59 1.552(14) .
C56 C57 1.398(13) .
C56 H36 0.9500 .
C57 C58 1.419(12) .
C58 O6 1.234(11) .
C58 H37 0.9500 .
C59 C60 1.483(19) .
C59 C62 1.530(19) .
C59 C61 1.547(17) .
C60 H38 0.9800 .
C60 H39 0.9800 .
C60 H40 0.9800 .
C61 H41 0.9800 .
C61 H42 0.9800 .
C61 H43 0.9800 .
C62 H44 0.9800 .
C62 H45 0.9800 .
C62 H46 0.9800 .
Pd3 N6 1.952(7) .
Pd3 N5 1.963(7) .
Pd3 O9 1.966(5) .
Pd3 O7 1.996(5) .
Pd4 N7 1.954(6) .
Pd4 N8 1.976(8) .
Pd4 O11 1.983(5) .
Pd4 O10 1.991(6) .
Pd4 Pd5 3.160(2) .
C63 O7 1.268(10) .
C63 C64 1.415(11) .
C63 C68 1.495(12) .
C64 C65 1.439(13) .
C64 C74 1.502(12) .
C65 C66 1.366(15) .
C65 H47 0.9500 .
C66 C67 1.389(15) .
C66 C70 1.522(15) .
C67 C68 1.375(13) .
C67 H48 0.9500 .
C68 C69 1.430(12) .
C69 O8 1.206(9) .
C69 H49 0.9500 .
C70 C71 1.51(2) .
C70 C73 1.529(19) .
C70 C72 1.56(2) .
C71 H50 0.9800 .
C71 H51 0.9800 .
C71 H52 0.9800 .
C72 H53 0.9800 .
C72 H54 0.9800 .
C72 H55 0.9800 .
C73 H56 0.9800 .
C73 H57 0.9800 .
C73 H58 0.9800 .
N5 C78 1.333(10) .
N5 C74 1.363(11) .
C74 C75 1.421(12) .
C75 C76 1.373(15) .
C75 H59 0.9500 .
C76 C77 1.368(15) .
C76 H60 0.9500 .
C77 C78 1.377(12) .
C77 H61 0.9500 .
C78 C79 1.495(13) .
N6 C79 1.323(10) .
N6 C83 1.365(11) .
C79 C80 1.346(12) .
C80 C81 1.324(15) .
C80 H62 0.9500 .
C81 C82 1.403(15) .
C81 H63 0.9500 .
C82 C83 1.403(11) .
C82 H64 0.9500 .
C83 C86 1.495(11) .
C84 C85 1.418(11) .
C84 C93 1.420(10) .
C84 C94 1.486(10) .
C85 O9 1.321(9) .
C85 C86 1.442(10) .
C86 C87 1.366(11) .
C87 C88 1.425(13) .
C87 H65 0.9500 .
C88 C93 1.402(12) .
C88 C89 1.442(12) .
C89 C90 1.362(15) .
C89 H66 0.9500 .
C90 C91 1.402(14) .
C90 H67 0.9500 .
C91 C92 1.378(12) .
C91 H68 0.9500 .
C92 C93 1.437(11) .
C92 H69 0.9500 .
C94 C103 1.404(11) .
C94 C95 1.409(11) .
C95 O10 1.293(9) .
C95 C96 1.435(10) .
C96 C97 1.354(11) .
C96 C104 1.488(11) .
C97 C98 1.391(11) .
C97 H70 0.9500 .
C98 C103 1.436(10) .
C98 C99 1.445(12) .
C99 C100 1.381(13) .
C99 H71 0.9500 .
C100 C101 1.399(13) .
C100 H72 0.9500 .
C101 C102 1.400(13) .
C101 H73 0.9500 .
C102 C103 1.423(11) .
C102 H74 0.9500 .
N7 C104 1.355(10) .
N7 C108 1.358(10) .
C104 C105 1.391(10) .
C105 C106 1.371(13) .
C105 H75 0.9500 .
C106 C107 1.386(13) .
C106 H76 0.9500 .
C107 C108 1.381(11) .
C107 H77 0.9500 .
C108 C109 1.447(13) .
N8 C113 1.319(11) .
N8 C109 1.394(12) .
C109 C110 1.392(14) .
C110 C111 1.384(15) .
C110 H78 0.9500 .
C111 C112 1.407(16) .
C111 H79 0.9500 .
C112 C113 1.404(15) .
C112 H80 0.9500 .
C113 C115 1.450(13) .
C114 O11 1.318(11) .
C114 C115 1.419(15) .
C114 C119 1.443(12) .
C115 C116 1.448(13) .
C116 C117 1.418(16) .
C116 H81 0.9500 .
C117 C118 1.343(18) .
C117 C121 1.566(17) .
C118 C119 1.423(14) .
C118 H82 0.9500 .
C119 C120 1.464(16) .
C120 O12 1.234(11) .
C120 H83 0.9500 .
C121 C123 1.494(18) .
C121 C122 1.577(19) .
C121 C124 1.58(2) .
C122 H84 0.9800 .
C122 H85 0.9800 .
C122 H86 0.9800 .
C123 H87 0.9800 .
C123 H88 0.9800 .
C123 H89 0.9800 .
C124 H90 0.9800 .
C124 H91 0.9800 .
C124 H92 0.9800 .
Pd5 N9 1.964(9) .
Pd5 O15 1.968(8) .
Pd5 O13 1.986(7) .
Pd5 N10 1.986(9) .
C125 O13 1.319(11) .
C125 C130 1.408(16) .
C125 C126 1.419(17) .
C126 C127 1.444(13) .
C126 C136 1.455(17) .
C127 C128 1.38(2) .
C127 H93 0.9500 .
C128 C129 1.29(2) .
C128 C132 1.600(16) .
C129 C130 1.370(15) .
C129 H94 0.9500 .
C130 C131 1.529(19) .
C131 O14 1.209(14) .
C131 H95 0.9500 .
C132 C134 1.42(2) .
C132 C133 1.558(18) .
C132 C135 1.57(3) .
C133 H96 0.9800 .
C133 H97 0.9800 .
C133 H98 0.9800 .
C134 H99 0.9800 .
C134 H100 0.9800 .
C134 H101 0.9800 .
C135 H102 0.9800 .
C135 H103 0.9800 .
C135 H104 0.9800 .
N9 C136 1.324(13) .
N9 C140 1.376(15) .
C136 C137 1.493(17) .
C137 C138 1.320(19) .
C137 H105 0.9500 .
C138 C139 1.348(18) .
C138 H106 0.9500 .
C139 C140 1.382(16) .
C139 H107 0.9500 .
C140 C141 1.411(15) .
N10 C145 1.323(13) .
N10 C141 1.401(14) .
C141 C142 1.387(16) .
C142 C143 1.400(18) .
C142 H108 0.9500 .
C143 C144 1.378(17) .
C143 H109 0.9500 .
C144 C145 1.438(13) .
C144 H110 0.9500 .
C145 C169 1.568(15) .
O15 C168 1.351(12) .
Pd6 O18 1.966(12) .
Pd6 O16 1.971(11) .
Pd6 N11 1.977(13) .
Pd6 N12 2.002(12) .
C146 O16 1.323(16) .
C146 C151 1.393(19) .
C146 C147 1.41(2) .
C147 C148 1.447(17) .
C147 C157 1.45(2) .
C148 C149 1.40(3) .
C148 H111 0.9500 .
C149 C150 1.27(3) .
C149 C153 1.61(2) .
C150 C151 1.376(19) .
C150 H112 0.9500 .
C151 C152 1.54(2) .
C152 O17 1.218(19) .
C152 H113 0.9500 .
C153 C155 1.40(3) .
C153 C154 1.54(2) .
C153 C156 1.59(3) .
C154 H114 0.9800 .
C154 H115 0.9800 .
C154 H116 0.9800 .
C155 H117 0.9800 .
C155 H118 0.9800 .
C155 H119 0.9800 .
C156 H120 0.9800 .
C156 H121 0.9800 .
C156 H122 0.9800 .
N11 C157 1.350(17) .
N11 C161 1.368(18) .
C157 C158 1.49(2) .
C158 C159 1.32(2) .
C158 H123 0.9500 .
C159 C160 1.35(2) .
C159 H124 0.9500 .
C160 C161 1.383(19) .
C160 H125 0.9500 .
C161 C162 1.403(19) .
N12 C166 1.316(17) .
N12 C162 1.410(17) .
C162 C163 1.39(2) .
C163 C164 1.40(2) .
C163 H126 0.9500 .
C164 C165 1.37(2) .
C164 H127 0.9500 .
C165 C166 1.437(17) .
C165 H128 0.9500 .
C166 C169 1.38(2) .
O18 C168 1.268(19) .
Pd7 O19 1.952(6) .
Pd7 O20 1.967(6) .
Pd7 N13 1.967(7) .
Pd7 N14 1.985(6) .
C167 C168 1.396(12) .
C167 C176 1.447(11) .
C167 C177 1.463(14) .
C168 C169 1.414(12) .
C169 C170 1.407(10) .
C170 C171 1.385(15) .
C170 H129 0.9500 .
C171 C176 1.406(15) .
C171 C172 1.413(12) .
C172 C173 1.36(2) .
C172 H130 0.9500 .
C173 C174 1.37(2) .
C173 H131 0.9500 .
C174 C175 1.365(16) .
C174 H132 0.9500 .
C175 C176 1.430(14) .
C175 H133 0.9500 .
C177 C186 1.409(16) .
C177 C178 1.433(14) .
C178 O19 1.302(12) .
C178 C179 1.468(13) .
C179 C180 1.392(16) .
C179 C187 1.477(13) .
C180 C181 1.428(15) .
C180 H134 0.9500 .
C181 C182 1.382(18) .
C181 C186 1.411(15) .
C182 C183 1.376(19) .
C182 H135 0.9500 .
C183 C184 1.45(2) .
C183 H136 0.9500 .
C184 C185 1.338(18) .
C184 H137 0.9500 .
C185 C186 1.400(14) .
C185 H138 0.9500 .
N13 C191 1.292(11) .
N13 C187 1.372(13) .
C187 C188 1.406(12) .
C188 C189 1.369(14) .
C188 H139 0.9500 .
C189 C190 1.383(15) .
C189 H140 0.9500 .
C190 C191 1.410(13) .
C190 H141 0.9500 .
C191 C192 1.472(14) .
N14 C196 1.355(11) .
N14 C192 1.377(11) .
C192 C193 1.405(12) .
C193 C194 1.355(15) .
C193 H142 0.9500 .
C194 C195 1.390(13) .
C194 H143 0.9500 .
C195 C196 1.391(11) .
C195 H144 0.9500 .
C196 C198 1.459(11) .
C197 O20 1.306(11) .
C197 C202 1.425(13) .
C197 C198 1.443(12) .
C198 C199 1.384(13) .
C199 C200 1.434(13) .
C199 H145 0.9500 .
C200 C201 1.363(13) .
C200 C204 1.534(15) .
C201 C202 1.381(14) .
C201 H146 0.9500 .
C202 C203 1.450(13) .
C203 O21 1.230(12) .
C203 H147 0.9500 .
C204 C205 1.467(16) .
C204 C206 1.517(16) .
C204 C207 1.525(17) .
C205 H148 0.9800 .
C205 H149 0.9800 .
C205 H150 0.9800 .
C206 H151 0.9800 .
C206 H152 0.9800 .
C206 H153 0.9800 .
C207 H154 0.9800 .
C207 H155 0.9800 .
C207 H156 0.9800 .
Pd8 O22 1.955(6) .
Pd8 N16 1.958(6) .
Pd8 O24 1.964(5) .
Pd8 N15 1.968(6) .
C208 O22 1.353(9) .
C208 C209 1.385(13) .
C208 C213 1.466(14) .
C209 C219 1.388(14) .
C209 C210 1.433(13) .
C210 C211 1.394(15) .
C210 H157 0.9500 .
C211 C212 1.336(16) .
C211 C215 1.550(14) .
C212 C213 1.460(13) .
C212 H158 0.9500 .
C213 C214 1.434(15) .
C214 O23 1.229(12) .
C214 H159 0.9500 .
C215 C217 1.507(18) .
C215 C216 1.53(2) .
C215 C218 1.539(19) .
C216 H160 0.9800 .
C216 H161 0.9800 .
C216 H162 0.9800 .
C217 H163 0.9800 .
C217 H164 0.9800 .
C217 H165 0.9800 .
C218 H166 0.9800 .
C218 H167 0.9800 .
C218 H168 0.9800 .
N15 C219 1.346(12) .
N15 C223 1.347(12) .
C219 C220 1.449(13) .
C220 C221 1.382(16) .
C220 H169 0.9500 .
C221 C222 1.357(16) .
C221 H170 0.9500 .
C222 C223 1.382(11) .
C222 H171 0.9500 .
C223 C224 1.460(14) .
N16 C228 1.379(10) .
N16 C224 1.389(10) .
C224 C225 1.376(13) .
C225 C226 1.363(14) .
C225 H172 0.9500 .
C226 C227 1.385(14) .
C226 H173 0.9500 .
C227 C228 1.400(12) .
C227 H174 0.9500 .
C228 C231 1.454(10) .
C229 C238 1.402(10) .
C229 C230 1.413(9) .
C229 C239 1.477(10) .
C230 O24 1.304(8) .
C230 C231 1.427(10) .
C231 C232 1.425(11) .
C232 C233 1.346(12) .
C232 H175 0.9500 .
C233 C238 1.400(12) .
C233 C234 1.437(11) .
C234 C235 1.348(15) .
C234 H176 0.9500 .
C235 C236 1.379(15) .
C235 H177 0.9500 .
C236 C237 1.372(12) .
C236 H178 0.9500 .
C237 C238 1.435(11) .
C237 H179 0.9500 .
C239 C240 1.402(10) .
C239 C248 1.437(9) .
C240 O25 1.315(11) .
C240 O28 1.41(2) .
C240 C241 1.437(10) .
C241 C242 1.346(10) .
C241 C249 1.438(13) .
C241 C270 1.64(2) .
C242 C243 1.413(13) .
C242 H180 0.9500 .
C243 C244 1.396(12) .
C243 C248 1.422(12) .
C244 C245 1.322(15) .
C244 H181 0.9500 .
C245 C246 1.413(16) .
C245 H182 0.9500 .
C246 C247 1.356(12) .
C246 H183 0.9500 .
C247 C248 1.429(12) .
C247 H184 0.9500 .
Pd9 O26 1.942(7) .
Pd9 N18 1.952(8) .
Pd9 N17 1.968(8) .
Pd9 O25 1.977(6) .
Pd9 Pd11 3.2461(13) .
N17 C249 1.356(12) .
N17 C253 1.360(12) .
C249 C250 1.397(13) .
C250 C251 1.378(16) .
C250 H185 0.9500 .
C251 C252 1.392(17) .
C251 H186 0.9500 .
C252 C253 1.359(16) .
C252 H187 0.9500 .
C253 C254 1.511(15) .
N18 C258 1.358(13) .
N18 C254 1.386(14) .
C254 C255 1.344(14) .
C255 C256 1.388(18) .
C255 H188 0.9500 .
C256 C257 1.265(19) .
C256 H189 0.9500 .
C257 C258 1.411(15) .
C257 H190 0.9500 .
C258 C260 1.517(16) .
C259 O26 1.351(9) .
C259 C264 1.385(14) .
C259 C260 1.399(15) .
C260 C261 1.396(12) .
C261 C262 1.264(18) .
C261 H191 0.9500 .
C262 C263 1.421(19) .
C262 C266 1.587(14) .
C263 C264 1.382(12) .
C263 H192 0.9500 .
C264 C265 1.552(16) .
C265 O27 1.206(13) .
C265 H193 0.9500 .
C266 C269 1.45(2) .
C266 C268 1.515(19) .
C266 C267 1.53(2) .
C267 H194 0.9800 .
C267 H195 0.9800 .
C267 H196 0.9800 .
C268 H197 0.9800 .
C268 H198 0.9800 .
C268 H199 0.9800 .
C269 H200 0.9800 .
C269 H201 0.9800 .
C269 H202 0.9800 .
Pd10 O29 1.942(14) .
Pd10 N20 1.947(14) .
Pd10 O28 1.968(14) .
Pd10 N19 1.984(14) .
N19 C274 1.352(18) .
N19 C270 1.353(19) .
C270 C271 1.40(2) .
C271 C272 1.39(2) .
C271 H203 0.9500 .
C272 C273 1.39(2) .
C272 H204 0.9500 .
C273 C274 1.36(2) .
C273 H205 0.9500 .
C274 C275 1.51(2) .
N20 C275 1.38(2) .
N20 C279 1.381(19) .
C275 C276 1.35(2) .
C276 C277 1.38(2) .
C276 H206 0.9500 .
C277 C278 1.28(3) .
C277 H207 0.9500 .
C278 C279 1.42(2) .
C278 H208 0.9500 .
C279 C281 1.52(2) .
C280 O29 1.343(16) .
C280 C281 1.38(2) .
C280 C285 1.39(2) .
C281 C282 1.416(19) .
C282 C283 1.26(2) .
C282 H209 0.9500 .
C283 C284 1.43(2) .
C283 C287 1.589(19) .
C284 C285 1.379(18) .
C284 H210 0.9500 .
C285 C286 1.55(2) .
C286 O30 1.21(2) .
C286 H211 0.9500 .
C287 C290 1.45(3) .
C287 C289 1.51(2) .
C287 C288 1.53(3) .
C288 H212 0.9800 .
C288 H213 0.9800 .
C288 H214 0.9800 .
C289 H215 0.9800 .
C289 H216 0.9800 .
C289 H217 0.9800 .
C290 H218 0.9800 .
C290 H219 0.9800 .
C290 H220 0.9800 .
Pd11 N21 1.972(8) .
Pd11 O33 1.973(6) .
Pd11 N22 1.979(6) .
Pd11 O31 1.995(5) .
Pd12 N23 1.963(6) .
Pd12 O34 1.972(5) .
Pd12 N24 1.976(6) .
Pd12 O35 1.976(4) .
Pd12 Pd13 3.2589(7) .
C291 O31 1.298(11) .
C291 C296 1.427(12) .
C291 C292 1.435(14) .
C292 C293 1.424(14) .
C292 C302 1.484(13) .
C293 C294 1.391(14) .
C293 H221 0.9500 .
C294 C295 1.367(16) .
C294 C298 1.559(15) .
C295 C296 1.366(15) .
C295 H222 0.9500 .
C296 C297 1.400(15) .
C297 O32 1.256(10) .
C297 H223 0.9500 .
C298 C301 1.497(18) .
C298 C300 1.546(16) .
C298 C299 1.570(16) .
C299 H224 0.9800 .
C299 H225 0.9800 .
C299 H226 0.9800 .
C300 H227 0.9800 .
C300 H228 0.9800 .
C300 H229 0.9800 .
C301 H230 0.9800 .
C301 H231 0.9800 .
C301 H232 0.9800 .
N21 C302 1.351(11) .
N21 C306 1.378(10) .
C302 C303 1.378(13) .
C303 C304 1.346(14) .
C303 H233 0.9500 .
C304 C305 1.386(13) .
C304 H234 0.9500 .
C305 C306 1.357(13) .
C305 H235 0.9500 .
C306 C307 1.444(12) .
N22 C311 1.326(10) .
N22 C307 1.370(10) .
C307 C308 1.401(11) .
C308 C309 1.338(13) .
C308 H236 0.9500 .
C309 C310 1.383(13) .
C309 H237 0.9500 .
C310 C311 1.392(11) .
C310 H238 0.9500 .
C311 C314 1.501(11) .
C312 C313 1.405(12) .
C312 C321 1.410(12) .
C312 C322 1.500(11) .
C313 O33 1.316(9) .
C313 C314 1.431(10) .
C314 C315 1.382(11) .
C315 C316 1.401(12) .
C315 H239 0.9500 .
C316 C321 1.419(12) .
C316 C317 1.438(12) .
C317 C318 1.354(15) .
C317 H240 0.9500 .
C318 C319 1.392(16) .
C318 H241 0.9500 .
C319 C320 1.337(14) .
C319 H242 0.9500 .
C320 C321 1.432(13) .
C320 H243 0.9500 .
C322 C323 1.382(11) .
C322 C331 1.437(11) .
C323 O34 1.350(9) .
C323 C324 1.444(11) .
C324 C325 1.397(11) .
C324 C332 1.476(11) .
C325 C326 1.406(13) .
C325 H244 0.9500 .
C326 C331 1.393(12) .
C326 C327 1.418(12) .
C327 C328 1.359(15) .
C327 H245 0.9500 .
C328 C329 1.414(15) .
C328 H246 0.9500 .
C329 C330 1.345(12) .
C329 H247 0.9500 .
C330 C331 1.436(12) .
C330 H248 0.9500 .
N23 C332 1.333(10) .
N23 C336 1.374(10) .
C332 C333 1.422(11) .
C333 C334 1.372(14) .
C333 H249 0.9500 .
C334 C335 1.389(14) .
C334 H250 0.9500 .
C335 C336 1.369(11) .
C335 H251 0.9500 .
C336 C337 1.464(12) .
N24 C341 1.340(10) .
N24 C337 1.384(9) .
C337 C338 1.366(12) .
C338 C339 1.385(13) .
C338 H252 0.9500 .
C339 C340 1.359(12) .
C339 H253 0.9500 .
C340 C341 1.413(11) .
C340 H254 0.9500 .
C341 C343 1.456(11) .
C342 O35 1.370(9) .
C342 C343 1.383(10) .
C342 C347 1.425(10) .
C343 C344 1.424(11) .
C344 C345 1.435(13) .
C344 H255 0.9500 .
C345 C346 1.402(13) .
C345 C349 1.526(12) .
C346 C347 1.365(11) .
C346 H256 0.9500 .
C347 C348 1.446(11) .
C348 O36 1.214(9) .
C348 H257 0.9500 .
C349 C352 1.504(13) .
C349 C351 1.541(13) .
C349 C350 1.559(15) .
C350 H258 0.9800 .
C350 H259 0.9800 .
C350 H260 0.9800 .
C351 H261 0.9800 .
C351 H262 0.9800 .
C351 H263 0.9800 .
C352 H264 0.9800 .
C352 H265 0.9800 .
C352 H266 0.9800 .
Pd13 N26 1.960(7) .
Pd13 O39 1.973(5) .
Pd13 O37 1.983(5) .
Pd13 N25 1.983(6) .
Pd14 O41 1.962(6) .
Pd14 N27 1.975(8) .
Pd14 O40 1.978(5) .
Pd14 N28 1.992(6) .
Pd14 Pd15 3.2234(7) .
C353 O37 1.360(8) .
C353 C354 1.383(9) .
C353 C358 1.398(10) .
C354 C355 1.367(10) .
C354 C364 1.499(11) .
C355 C356 1.427(11) .
C355 H267 0.9500 .
C356 C357 1.371(11) .
C356 C360 1.519(11) .
C357 C358 1.444(11) .
C357 H268 0.9500 .
C358 C359 1.427(11) .
C359 O38 1.228(10) .
C359 H269 0.9500 .
C360 C363 1.510(12) .
C360 C362 1.527(12) .
C360 C361 1.547(13) .
C361 H270 0.9800 .
C361 H271 0.9800 .
C361 H272 0.9800 .
C362 H273 0.9800 .
C362 H274 0.9800 .
C362 H275 0.9800 .
C363 H276 0.9800 .
C363 H277 0.9800 .
C363 H278 0.9800 .
N25 C364 1.337(9) .
N25 C368 1.357(10) .
C364 C365 1.428(10) .
C365 C366 1.368(11) .
C365 H279 0.9500 .
C366 C367 1.401(12) .
C366 H280 0.9500 .
C367 C368 1.387(11) .
C367 H281 0.9500 .
C368 C369 1.466(11) .
N26 C373 1.356(11) .
N26 C369 1.395(11) .
C369 C370 1.351(12) .
C370 C371 1.375(13) .
C370 H282 0.9500 .
C371 C372 1.383(15) .
C371 H283 0.9500 .
C372 C373 1.392(13) .
C372 H284 0.9500 .
C373 C376 1.479(13) .
C374 C375 1.400(11) .
C374 C383 1.416(10) .
C374 C384 1.482(13) .
C375 O39 1.326(9) .
C375 C376 1.451(13) .
C376 C377 1.380(11) .
C377 C378 1.373(13) .
C377 H285 0.9500 .
C378 C379 1.433(12) .
C378 C383 1.448(14) .
C379 C380 1.328(15) .
C379 H286 0.9500 .
C380 C381 1.385(16) .
C380 H287 0.9500 .
C381 C382 1.396(14) .
C381 H288 0.9500 .
C382 C383 1.420(12) .
C382 H289 0.9500 .
C384 C393 1.397(11) .
C384 C385 1.426(11) .
C385 O40 1.307(9) .
C385 C386 1.448(12) .
C386 C387 1.393(11) .
C386 C394 1.461(11) .
C387 C388 1.395(13) .
C387 H290 0.9500 .
C388 C389 1.416(12) .
C388 C393 1.420(14) .
C389 C390 1.383(14) .
C389 H291 0.9500 .
C390 C391 1.365(16) .
C390 H292 0.9500 .
C391 C392 1.374(13) .
C391 H293 0.9500 .
C392 C393 1.466(12) .
C392 H294 0.9500 .
N27 C394 1.310(10) .
N27 C398 1.380(11) .
C394 C395 1.434(13) .
C395 C396 1.374(14) .
C395 H295 0.9500 .
C396 C397 1.355(13) .
C396 H296 0.9500 .
C397 C398 1.353(13) .
C397 H297 0.9500 .
C398 C399 1.466(12) .
N28 C403 1.306(10) .
N28 C399 1.375(11) .
C399 C400 1.408(11) .
C400 C401 1.416(13) .
C400 H298 0.9500 .
C401 C402 1.338(15) .
C401 H299 0.9500 .
C402 C403 1.425(11) .
C402 H300 0.9500 .
C403 C405 1.482(13) .
C404 O41 1.321(8) .
C404 C409 1.389(12) .
C404 C405 1.423(10) .
C405 C406 1.382(12) .
C406 C407 1.361(14) .
C406 H301 0.9500 .
C407 C408 1.413(14) .
C407 C411 1.537(12) .
C408 C409 1.375(12) .
C408 H302 0.9500 .
C409 C410 1.471(14) .
C410 O42 1.230(12) .
C410 H303 0.9500 .
C411 C413 1.483(14) .
C411 C414 1.515(16) .
C411 C412 1.541(17) .
C412 H304 0.9800 .
C412 H305 0.9800 .
C412 H306 0.9800 .
C413 H307 0.9800 .
C413 H308 0.9800 .
C413 H309 0.9800 .
C414 H310 0.9800 .
C414 H311 0.9800 .
C414 H312 0.9800 .
Pd15 N30 1.953(6) .
Pd15 O45 1.961(5) .
Pd15 N29 1.979(7) .
Pd15 O43 1.996(5) .
Pd16 N31 1.963(5) .
Pd16 N32 1.980(6) .
Pd16 O46 1.982(5) .
Pd16 O47 1.996(5) .
Pd16 Pd1 3.2317(7) 1_654
C415 O43 1.303(9) .
C415 C416 1.388(10) .
C415 C420 1.438(10) .
C416 C417 1.368(11) .
C416 C426 1.514(11) .
C417 C418 1.411(12) .
C417 H313 0.9500 .
C418 C419 1.392(14) .
C418 C422 1.518(12) .
C419 C420 1.384(12) .
C419 H314 0.9500 .
C420 C421 1.469(12) .
C421 O44 1.206(10) .
C421 H315 0.9500 .
C422 C424 1.499(15) .
C422 C425 1.542(15) .
C422 C423 1.561(16) .
C423 H316 0.9800 .
C423 H317 0.9800 .
C423 H318 0.9800 .
C424 H319 0.9800 .
C424 H320 0.9800 .
C424 H321 0.9800 .
C425 H322 0.9800 .
C425 H323 0.9800 .
C425 H324 0.9800 .
N29 C426 1.352(10) .
N29 C430 1.386(10) .
C426 C427 1.405(11) .
C427 C428 1.383(13) .
C427 H325 0.9500 .
C428 C429 1.380(14) .
C428 H326 0.9500 .
C429 C430 1.357(13) .
C429 H327 0.9500 .
C430 C431 1.451(13) .
N30 C435 1.340(11) .
N30 C431 1.398(11) .
C431 C432 1.382(12) .
C432 C433 1.344(16) .
C432 H328 0.9500 .
C433 C434 1.368(14) .
C433 H329 0.9500 .
C434 C435 1.365(11) .
C434 H330 0.9500 .
C435 C438 1.491(13) .
C436 C437 1.397(12) .
C436 C445 1.405(11) .
C436 C446 1.494(11) .
C437 O45 1.320(9) .
C437 C438 1.452(11) .
C438 C439 1.383(11) .
C439 C440 1.399(13) .
C439 H331 0.9500 .
C440 C445 1.400(13) .
C440 C441 1.442(13) .
C441 C442 1.308(15) .
C441 H332 0.9500 .
C442 C443 1.395(15) .
C442 H333 0.9500 .
C443 C444 1.381(13) .
C443 H334 0.9500 .
C444 C445 1.441(12) .
C444 H335 0.9500 .
C446 C447 1.410(11) .
C446 C455 1.425(11) .
C447 O46 1.324(9) .
C447 C448 1.427(11) .
C448 C449 1.413(12) .
C448 C456 1.460(11) .
C449 C450 1.393(13) .
C449 H336 0.9500 .
C450 C455 1.403(12) .
C450 C451 1.430(12) .
C451 C452 1.358(15) .
C451 H337 0.9500 .
C452 C453 1.383(16) .
C452 H338 0.9500 .
C453 C454 1.380(14) .
C453 H339 0.9500 .
C454 C455 1.440(13) .
C454 H340 0.9500 .
N31 C456 1.342(10) .
N31 C460 1.369(10) .
C456 C457 1.410(11) .
C457 C458 1.360(14) .
C457 H341 0.9500 .
C458 C459 1.347(14) .
C458 H342 0.9500 .
C459 C460 1.392(12) .
C459 H343 0.9500 .
C460 C461 1.471(11) .
N32 C465 1.364(10) .
N32 C461 1.369(9) .
C461 C462 1.361(12) .
C462 C463 1.373(13) .
C462 H344 0.9500 .
C463 C464 1.380(11) .
C463 H345 0.9500 .
C464 C465 1.448(11) .
C464 H346 0.9500 .
C465 C467 1.415(11) .
C466 O47 1.333(9) .
C466 C471 1.414(10) .
C466 C467 1.467(11) .
C467 C468 1.405(11) .
C468 C469 1.346(13) .
C468 H347 0.9500 .
C469 C470 1.388(13) .
C469 C473 1.508(12) .
C470 C471 1.391(12) .
C470 H348 0.9500 .
C471 C472 1.437(12) .
C472 O48 1.237(9) .
C472 H349 0.9500 .
C473 C474 1.489(14) .
C473 C476 1.531(15) .
C473 C475 1.560(13) .
C474 H350 0.9800 .
C474 H351 0.9800 .
C474 H352 0.9800 .
C475 H353 0.9800 .
C475 H354 0.9800 .
C475 H355 0.9800 .
C476 H356 0.9800 .
C476 H357 0.9800 .
C476 H358 0.9800 .
O49 C477 1.28(2) .
C477 N33 1.37(2) .
C477 H359 0.9500 .
N33 C478 1.366(19) .
N33 C479 1.437(18) .
C478 H360 0.9800 .
C478 H361 0.9800 .
C478 H362 0.9800 .
C479 H363 0.9800 .
C479 H364 0.9800 .
C479 H365 0.9800 .
O50 C480 1.249(16) .
C480 N34 1.302(15) .
C480 H366 0.9500 .
N34 C482 1.419(17) .
N34 C481 1.426(15) .
C481 H367 0.9800 .
C481 H368 0.9800 .
C481 H369 0.9800 .
C482 H370 0.9800 .
C482 H371 0.9800 .
C482 H372 0.9800 .
O51 C483 1.224(17) .
C483 N35 1.361(18) .
C483 H373 0.9500 .
N35 C484 1.374(17) .
N35 C485 1.50(2) .
C484 H374 0.9800 .
C484 H375 0.9800 .
C484 H376 0.9800 .
C485 H377 0.9800 .
C485 H378 0.9800 .
C485 H379 0.9800 .
O52 C486 1.25(2) .
C486 N36 1.31(2) .
C486 H380 0.9500 .
N36 C488 1.24(2) .
N36 C487 1.45(2) .
C487 H381 0.9800 .
C487 H382 0.9800 .
C487 H383 0.9800 .
C488 H384 0.9800 .
C488 H385 0.9800 .
C488 H386 0.9800 .
O53 C489 1.27(3) .
C489 N37 1.29(3) .
C489 H387 0.9500 .
N37 C490 1.45(2) .
N37 C491 1.74(3) .
C490 H388 0.9800 .
C490 H389 0.9800 .
C490 H390 0.9800 .
C491 H391 0.9800 .
C491 H392 0.9800 .
C491 H393 0.9800 .
O54 C492 1.33(2) .
C492 N38 1.31(2) .
C492 H394 0.9500 .
N38 C494 1.35(3) .
N38 C493 1.64(2) .
C493 H395 0.9800 .
C493 H396 0.9800 .
C493 H397 0.9800 .
C494 H398 0.9800 .
C494 H399 0.9800 .
C494 H400 0.9800 .
O55 C495 1.47(3) .
C495 N39 1.51(3) .
C495 H401 0.9500 .
N39 C496 1.34(3) .
N39 C497 1.60(3) .
C496 H402 0.9800 .
C496 H403 0.9800 .
C496 H404 0.9800 .
C497 H405 0.9800 .
C497 H406 0.9800 .
C497 H407 0.9800 .
O56 C498 1.058(16) .
C498 N40 1.391(15) .
C498 H408 0.9500 .
N40 C500 1.444(17) .
N40 C499 1.495(17) .
C499 H409 0.9800 .
C499 H410 0.9800 .
C499 H411 0.9800 .
C500 H412 0.9800 .
C500 H413 0.9800 .
C500 H414 0.9800 .
O57 C501 1.374(18) .
C501 N41 1.469(16) .
C501 H415 0.9500 .
N41 C502 1.400(16) .
N41 C503 1.463(17) .
C502 H416 0.9800 .
C502 H417 0.9800 .
C502 H418 0.9800 .
C503 H419 0.9800 .
C503 H420 0.9800 .
C503 H421 0.9800 .
O58 C504 1.183(17) .
C504 N42 1.340(15) .
C504 H422 0.9500 .
N42 C505 1.443(16) .
N42 C506 1.491(16) .
C505 H423 0.9800 .
C505 H424 0.9800 .
C505 H425 0.9800 .
C506 H426 0.9800 .
C506 H427 0.9800 .
C506 H428 0.9800 .
O59 C507 1.197(15) .
C507 N43 1.379(14) .
C507 H429 0.9500 .
N43 C509 1.451(15) .
N43 C508 1.463(15) .
C508 H430 0.9800 .
C508 H431 0.9800 .
C508 H432 0.9800 .
C509 H433 0.9800 .
C509 H434 0.9800 .
C509 H435 0.9800 .
O60 C510 1.251(16) .
C510 N44 1.394(15) .
C510 H436 0.9500 .
N44 C511 1.448(16) .
N44 C512 1.457(15) .
C511 H437 0.9800 .
C511 H438 0.9800 .
C511 H439 0.9800 .
C512 H440 0.9800 .
C512 H441 0.9800 .
C512 H442 0.9800 .
O61 C513 1.232(19) .
C513 N45 1.360(16) .
C513 H443 0.9500 .
N45 C514 1.455(17) .
N45 C515 1.468(17) .
C514 H444 0.9800 .
C514 H445 0.9800 .
C514 H446 0.9800 .
C515 H447 0.9800 .
C515 H448 0.9800 .
C515 H449 0.9800 .
O62 C516 1.216(17) .
C516 N46 1.371(15) .
C516 H450 0.9500 .
N46 C518 1.449(16) .
N46 C517 1.467(17) .
C517 H451 0.9800 .
C517 H452 0.9800 .
C517 H453 0.9800 .
C518 H454 0.9800 .
C518 H455 0.9800 .
C518 H456 0.9800 .
O63 C519 1.214(17) .
C519 N47 1.372(15) .
C519 H457 0.9500 .
N47 C521 1.435(16) .
N47 C520 1.492(17) .
C520 H458 0.9800 .
C520 H459 0.9800 .
C520 H460 0.9800 .
C521 H461 0.9800 .
C521 H462 0.9800 .
C521 H463 0.9800 .
O64 C522 1.220(16) .
C522 N48 1.369(15) .
C522 H464 0.9500 .
N48 C523 1.455(16) .
N48 C524 1.457(15) .
C523 H465 0.9800 .
C523 H466 0.9800 .
C523 H467 0.9800 .
C524 H468 0.9800 .
C524 H469 0.9800 .
C524 H470 0.9800 .
O65 C525 1.196(16) .
C525 N49 1.365(15) .
C525 H471 0.9500 .
N49 C527 1.453(15) .
N49 C526 1.474(16) .
C526 H472 0.9800 .
C526 H473 0.9800 .
C526 H474 0.9800 .
C527 H475 0.9800 .
C527 H476 0.9800 .
C527 H477 0.9800 .
O66 C528 1.189(16) .
C528 N50 1.374(15) .
C528 H478 0.9500 .
N50 C529 1.400(16) .
N50 C530 1.483(16) .
C529 H479 0.9800 .
C529 H480 0.9800 .
C529 H481 0.9800 .
C530 H482 0.9800 .
C530 H483 0.9800 .
C530 H484 0.9800 .
O67 C531 1.181(17) .
C531 N51 1.308(15) .
C531 H485 0.9500 .
N51 C532 1.476(17) .
N51 C533 1.495(16) .
C532 H486 0.9800 .
C532 H487 0.9800 .
C532 H488 0.9800 .
C533 H489 0.9800 .
C533 H490 0.9800 .
C533 H491 0.9800 .
O68 C534 1.235(16) .
C534 N52 1.375(15) .
C534 H492 0.9500 .
N52 C535 1.449(15) .
N52 C536 1.450(15) .
C535 H493 0.9800 .
C535 H494 0.9800 .
C535 H495 0.9800 .
C536 H496 0.9800 .
C536 H497 0.9800 .
C536 H498 0.9800 .
O69 C537 1.289(16) .
C537 N53 1.401(15) .
C537 H499 0.9500 .
N53 C539 1.418(15) .
N53 C538 1.475(16) .
C538 H500 0.9800 .
C538 H501 0.9800 .
C538 H502 0.9800 .
C539 H503 0.9800 .
C539 H504 0.9800 .
C539 H505 0.9800 .
O70 C540 1.203(16) .
C540 N54 1.354(15) .
C540 H506 0.9500 .
N54 C542 1.443(15) .
N54 C541 1.481(16) .
C541 H507 0.9800 .
C541 H508 0.9800 .
C541 H509 0.9800 .
C542 H510 0.9800 .
C542 H511 0.9800 .
C542 H512 0.9800 .
O71 C543 1.216(17) .
C543 N55 1.366(15) .
C543 H513 0.9500 .
N55 C544 1.455(16) .
N55 C545 1.459(16) .
C544 H514 0.9800 .
C544 H515 0.9800 .
C544 H516 0.9800 .
C545 H517 0.9800 .
C545 H518 0.9800 .
C545 H519 0.9800 .
O72 C546 1.239(17) .
C546 N56 1.364(15) .
C546 H520 0.9500 .
N56 C548 1.454(15) .
N56 C547 1.456(16) .
C547 H521 0.9800 .
C547 H522 0.9800 .
C547 H523 0.9800 .
C548 H524 0.9800 .
C548 H525 0.9800 .
C548 H526 0.9800 .
O73 C549 1.241(18) .
C549 N57 1.384(16) .
C549 H527 0.9500 .
N57 C551 1.426(16) .
N57 C550 1.466(17) .
C550 H528 0.9800 .
C550 H529 0.9800 .
C550 H530 0.9800 .
C551 H531 0.9800 .
C551 H532 0.9800 .
C551 H533 0.9800 .
O74 C552 1.232(15) .
C552 N58 1.391(14) .
C552 H534 0.9500 .
N58 C554 1.417(14) .
N58 C553 1.458(15) .
C553 H535 0.9800 .
C553 H536 0.9800 .
C553 H537 0.9800 .
C554 H538 0.9800 .
C554 H539 0.9800 .
C554 H540 0.9800 .
O75 C555 1.194(18) .
C555 N59 1.366(16) .
C555 H541 0.9500 .
N59 C556 1.449(17) .
N59 C557 1.462(17) .
C556 H542 0.9800 .
C556 H543 0.9800 .
C556 H544 0.9800 .
C557 H545 0.9800 .
C557 H546 0.9800 .
C557 H547 0.9800 .
O76 C558 1.173(18) .
C558 N60 1.344(16) .
C558 H548 0.9500 .
N60 C559 1.467(17) .
N60 C560 1.468(17) .
C559 H549 0.9800 .
C559 H550 0.9800 .
C559 H551 0.9800 .
C560 H552 0.9800 .
C560 H553 0.9800 .
C560 H554 0.9800 .
O77 C561 1.21(2) .
O77 H635 1.39(11) .
C561 N61 1.379(17) .
C561 H555 0.9500 .
N61 C562 1.448(18) .
N61 C563 1.454(17) .
C562 H556 0.9800 .
C562 H557 0.9800 .
C562 H558 0.9800 .
C563 H559 0.9800 .
C563 H560 0.9800 .
C563 H561 0.9800 .
O78 C564 1.165(18) .
C564 N62 1.349(16) .
C564 H562 0.9500 .
N62 C565 1.458(17) .
N62 C566 1.470(17) .
C565 H563 0.9800 .
C565 H564 0.9800 .
C565 H565 0.9800 .
C566 H566 0.9800 .
C566 H567 0.9800 .
C566 H568 0.9800 .
O79 C567 1.210(19) .
C567 N63 1.391(17) .
C567 H569 0.9500 .
N63 C569 1.441(17) .
N63 C568 1.453(18) .
C568 H570 0.9800 .
C568 H571 0.9800 .
C568 H572 0.9800 .
C569 H573 0.9800 .
C569 H574 0.9800 .
C569 H575 0.9800 .
O80 C570 1.215(19) .
C570 N64 1.385(17) .
C570 H576 0.9500 .
N64 C572 1.451(17) .
N64 C571 1.460(17) .
C571 H577 0.9800 .
C571 H578 0.9800 .
C571 H579 0.9800 .
C572 H580 0.9800 .
C572 H581 0.9800 .
C572 H582 0.9800 .
O81 C573 1.210(18) .
C573 N65 1.367(16) .
C573 H583 0.9500 .
N65 C574 1.446(17) .
N65 C575 1.476(17) .
C574 H584 0.9800 .
C574 H585 0.9800 .
C574 H586 0.9800 .
C575 H587 0.9800 .
C575 H588 0.9800 .
C575 H589 0.9800 .
O82 C576 1.164(17) .
C576 N66 1.375(15) .
C576 H590 0.9500 .
N66 C578 1.439(16) .
N66 C577 1.452(16) .
C577 H591 0.9800 .
C577 H592 0.9800 .
C577 H593 0.9800 .
C578 H594 0.9800 .
C578 H595 0.9800 .
C578 H596 0.9800 .
O83 C579 1.205(19) .
C579 N67 1.376(16) .
C579 H597 0.9500 .
N67 C581 1.448(17) .
N67 C580 1.453(17) .
C580 H598 0.9800 .
C580 H599 0.9800 .
C580 H600 0.9800 .
C581 H601 0.9800 .
C581 H602 0.9800 .
C581 H603 0.9800 .
C582 C583 1.463(15) .
C582 H604 0.9800 .
C582 H605 0.9800 .
C582 H606 0.9800 .
C583 O84 1.472(15) .
C583 H607 0.9900 .
C583 H608 0.9900 .
O84 C584 1.479(17) .
C584 C585 1.479(18) .
C584 H609 0.9900 .
C584 H610 0.9900 .
C585 H611 0.9800 .
C585 H612 0.9800 .
C585 H613 0.9800 .
O85 H614 0.859(19) .
O85 H615 0.86(2) .
O86 H616 0.86(2) .
O86 H617 0.856(17) .
O87 H618 0.854(18) .
O87 H619 0.866(19) .
O88 H620 0.849(19) .
O88 H621 0.85(2) .
O89 H622 0.85(2) .
O89 H623 0.848(19) .
O90 H624 0.856(19) .
O90 H625 0.85(2) .
O91 H626 0.85(2) .
O91 H627 0.852(19) .
O92 H628 0.86(2) .
O92 H629 0.85(2) .
O93 H630 0.85(2) .
O93 H631 0.852(19) .
O94 H632 0.86(2) .
O94 H633 0.848(19) .
O95 H634 0.845(19) .
O95 H635 0.84(2) .
O96 H636 0.851(19) .
O96 H637 0.86(2) .
O97 H638 0.85(2) .
O97 H639 0.85(2) .
O98 H640 0.85(2) .
O98 H641 0.85(2) .
O99 H642 0.85(2) .
O99 H643 0.84(2) .
O100 H644 0.843(19) .
O100 H645 0.843(19) .
O101 H646 0.838(19) .
O101 H647 0.84(2) .
O102 H648 0.846(19) .
O102 H649 0.84(2) .
O103 H650 0.85(2) .
O103 H651 0.849(19) .
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
O1 C1 C2 C3 173.5(7) .
C6 C1 C2 C3 -3.9(11) .
O1 C1 C2 C12 -9.1(13) .
C6 C1 C2 C12 173.5(7) .
C1 C2 C3 C4 4.0(13) .
C12 C2 C3 C4 -173.6(8) .
C2 C3 C4 C5 -3.2(14) .
C2 C3 C4 C8 175.7(8) .
C3 C4 C5 C6 2.5(13) .
C8 C4 C5 C6 -176.4(8) .
C4 C5 C6 C1 -2.7(12) .
C4 C5 C6 C7 178.0(8) .
O1 C1 C6 C5 -174.4(6) .
C2 C1 C6 C5 3.4(10) .
O1 C1 C6 C7 4.9(10) .
C2 C1 C6 C7 -177.3(7) .
C2 C1 O1 Pd1 -9.1(10) .
C6 C1 O1 Pd1 168.3(4) .
O3 Pd1 O1 C1 -171.3(5) .
N1 Pd1 O1 C1 13.2(5) .
Pd16 Pd1 O1 C1 96.7(5) 1_456
C5 C6 C7 O2 -7.6(12) .
C1 C6 C7 O2 173.1(8) .
C5 C4 C8 C9 -14.6(15) .
C3 C4 C8 C9 166.7(10) .
C5 C4 C8 C11 -135.8(11) .
C3 C4 C8 C11 45.4(14) .
C5 C4 C8 C10 106.1(12) .
C3 C4 C8 C10 -72.7(13) .
O1 Pd1 N1 C12 -4.3(6) .
N2 Pd1 N1 C12 177.9(7) .
Pd16 Pd1 N1 C12 -91.5(6) 1_456
O1 Pd1 N1 C16 167.1(5) .
N2 Pd1 N1 C16 -10.7(5) .
Pd16 Pd1 N1 C16 79.8(5) 1_456
C16 N1 C12 C13 -1.3(11) .
Pd1 N1 C12 C13 169.2(6) .
C16 N1 C12 C2 179.8(7) .
Pd1 N1 C12 C2 -9.7(10) .
C1 C2 C12 N1 19.0(12) .
C3 C2 C12 N1 -163.6(7) .
C1 C2 C12 C13 -159.8(8) .
C3 C2 C12 C13 17.6(11) .
N1 C12 C13 C14 3.9(12) .
C2 C12 C13 C14 -177.2(8) .
C12 C13 C14 C15 -3.5(15) .
C13 C14 C15 C16 0.4(15) .
C12 N1 C16 C15 -1.9(12) .
Pd1 N1 C16 C15 -173.6(7) .
C12 N1 C16 C17 179.8(7) .
Pd1 N1 C16 C17 8.1(9) .
C14 C15 C16 N1 2.3(14) .
C14 C15 C16 C17 -179.5(9) .
O3 Pd1 N2 C17 -163.6(6) .
N1 Pd1 N2 C17 11.9(6) .
Pd16 Pd1 N2 C17 -71.8(6) 1_456
O3 Pd1 N2 C21 8.6(7) .
N1 Pd1 N2 C21 -175.9(7) .
Pd16 Pd1 N2 C21 100.4(6) 1_456
C21 N2 C17 C18 -2.9(14) .
Pd1 N2 C17 C18 169.2(7) .
C21 N2 C17 C16 177.1(8) .
Pd1 N2 C17 C16 -10.8(10) .
N1 C16 C17 N2 1.7(11) .
C15 C16 C17 N2 -176.6(8) .
N1 C16 C17 C18 -178.3(9) .
C15 C16 C17 C18 3.4(15) .
N2 C17 C18 C19 -1.6(15) .
C16 C17 C18 C19 178.3(10) .
C17 C18 C19 C20 2.9(18) .
C18 C19 C20 C21 0.2(18) .
C17 N2 C21 C20 6.1(13) .
Pd1 N2 C21 C20 -165.3(7) .
C17 N2 C21 C24 -170.1(8) .
Pd1 N2 C21 C24 18.5(11) .
C19 C20 C21 N2 -4.5(15) .
C19 C20 C21 C24 171.8(10) .
C31 C22 C23 O3 -179.0(6) .
C32 C22 C23 O3 6.5(10) .
C31 C22 C23 C24 -4.5(11) .
C32 C22 C23 C24 -178.9(7) .
O3 C23 C24 C25 -178.8(7) .
C22 C23 C24 C25 7.1(12) .
O3 C23 C24 C21 -3.6(12) .
C22 C23 C24 C21 -177.8(7) .
N2 C21 C24 C25 148.0(9) .
C20 C21 C24 C25 -28.2(12) .
N2 C21 C24 C23 -27.2(13) .
C20 C21 C24 C23 156.6(8) .
C23 C24 C25 C26 -4.8(13) .
C21 C24 C25 C26 179.9(8) .
C24 C25 C26 C31 -0.2(14) .
C24 C25 C26 C27 176.5(9) .
C25 C26 C27 C28 -176.6(11) .
C31 C26 C27 C28 0.2(16) .
C26 C27 C28 C29 -0.1(18) .
C27 C28 C29 C30 -1.4(16) .
C28 C29 C30 C31 3.0(13) .
C29 C30 C31 C26 -2.9(12) .
C29 C30 C31 C22 172.2(8) .
C25 C26 C31 C30 178.2(8) .
C27 C26 C31 C30 1.3(13) .
C25 C26 C31 C22 2.9(13) .
C27 C26 C31 C22 -174.0(8) .
C23 C22 C31 C30 -175.6(7) .
C32 C22 C31 C30 -1.3(12) .
C23 C22 C31 C26 -0.5(11) .
C32 C22 C31 C26 173.8(8) .
C22 C23 O3 Pd1 -148.8(5) .
C24 C23 O3 Pd1 36.9(9) .
O1 Pd1 O3 C23 147.1(5) .
N2 Pd1 O3 C23 -35.2(5) .
Pd16 Pd1 O3 C23 -125.1(5) 1_456
C23 C22 C32 C41 -110.7(9) .
C31 C22 C32 C41 75.0(10) .
C23 C22 C32 C33 66.5(9) .
C31 C22 C32 C33 -107.8(8) .
C41 C32 C33 O4 -176.9(6) .
C22 C32 C33 O4 5.9(10) .
C41 C32 C33 C34 -0.7(10) .
C22 C32 C33 C34 -178.0(7) .
O4 C33 C34 C35 -179.2(7) .
C32 C33 C34 C35 4.9(10) .
O4 C33 C34 C42 -3.6(11) .
C32 C33 C34 C42 -179.5(7) .
C33 C34 C35 C36 -5.2(11) .
C42 C34 C35 C36 178.9(7) .
C34 C35 C36 C41 1.0(12) .
C34 C35 C36 C37 -179.9(8) .
C41 C36 C37 C38 0.0(14) .
C35 C36 C37 C38 -179.1(9) .
C36 C37 C38 C39 -3.2(16) .
C37 C38 C39 C40 3.6(16) .
C38 C39 C40 C41 -0.9(14) .
C37 C36 C41 C40 2.6(12) .
C35 C36 C41 C40 -178.3(7) .
C37 C36 C41 C32 -175.8(7) .
C35 C36 C41 C32 3.4(11) .
C39 C40 C41 C36 -2.2(12) .
C39 C40 C41 C32 176.2(8) .
C33 C32 C41 C36 -3.4(11) .
C22 C32 C41 C36 173.6(7) .
C33 C32 C41 C40 178.2(7) .
C22 C32 C41 C40 -4.7(12) .
C32 C33 O4 Pd2 -149.0(5) .
C34 C33 O4 Pd2 35.1(9) .
O5 Pd2 O4 C33 149.7(6) .
N3 Pd2 O4 C33 -33.6(6) .
N4 Pd2 N3 C42 -176.2(6) .
O4 Pd2 N3 C42 8.8(6) .
N4 Pd2 N3 C46 12.7(5) .
O4 Pd2 N3 C46 -162.2(5) .
C46 N3 C42 C43 7.4(12) .
Pd2 N3 C42 C43 -162.6(6) .
C46 N3 C42 C34 -174.2(7) .
Pd2 N3 C42 C34 15.8(11) .
C35 C34 C42 N3 151.2(7) .
C33 C34 C42 N3 -24.4(12) .
C35 C34 C42 C43 -30.5(12) .
C33 C34 C42 C43 153.9(8) .
N3 C42 C43 C44 -5.4(14) .
C34 C42 C43 C44 176.3(9) .
C42 C43 C44 C45 -1.4(16) .
C43 C44 C45 C46 6.4(16) .
C44 C45 C46 N3 -4.6(14) .
C44 C45 C46 C47 176.9(9) .
C42 N3 C46 C45 -2.6(12) .
Pd2 N3 C46 C45 168.7(7) .
C42 N3 C46 C47 176.1(7) .
Pd2 N3 C46 C47 -12.7(8) .
O5 Pd2 N4 C47 166.1(5) .
N3 Pd2 N4 C47 -10.6(5) .
O5 Pd2 N4 C51 -5.9(6) .
N3 Pd2 N4 C51 177.4(6) .
C51 N4 C47 C48 -0.0(11) .
Pd2 N4 C47 C48 -172.5(6) .
C51 N4 C47 C46 178.9(7) .
Pd2 N4 C47 C46 6.5(8) .
C45 C46 C47 N4 -177.2(9) .
N3 C46 C47 N4 4.3(10) .
C45 C46 C47 C48 1.7(14) .
N3 C46 C47 C48 -176.8(7) .
N4 C47 C48 C49 1.7(12) .
C46 C47 C48 C49 -177.2(8) .
C47 C48 C49 C50 -0.8(13) .
C48 C49 C50 C51 -1.6(12) .
C47 N4 C51 C50 -2.4(10) .
Pd2 N4 C51 C50 169.0(5) .
C47 N4 C51 C53 -179.4(7) .
Pd2 N4 C51 C53 -8.0(10) .
C49 C50 C51 N4 3.2(11) .
C49 C50 C51 C53 -179.7(7) .
O5 C52 C53 C54 175.7(7) .
C57 C52 C53 C54 -5.7(10) .
O5 C52 C53 C51 -2.7(11) .
C57 C52 C53 C51 176.0(7) .
N4 C51 C53 C54 -163.1(7) .
C50 C51 C53 C54 19.9(11) .
N4 C51 C53 C52 15.2(11) .
C50 C51 C53 C52 -161.8(7) .
C52 C53 C54 C55 4.2(13) .
C51 C53 C54 C55 -177.4(8) .
C53 C54 C55 C56 0.5(15) .
C53 C54 C55 C59 174.4(9) .
C54 C55 C56 C57 -3.3(14) .
C59 C55 C56 C57 -177.0(9) .
C55 C56 C57 C58 -177.5(8) .
C55 C56 C57 C52 1.4(13) .
O5 C52 C57 C56 -178.1(7) .
C53 C52 C57 C56 3.1(11) .
O5 C52 C57 C58 0.8(10) .
C53 C52 C57 C58 -178.0(7) .
C53 C52 O5 Pd2 -15.5(9) .
C57 C52 O5 Pd2 165.8(5) .
N4 Pd2 O5 C52 17.2(5) .
O4 Pd2 O5 C52 -168.0(5) .
C56 C57 C58 O6 -6.2(14) .
C52 C57 C58 O6 174.9(8) .
C56 C55 C59 C60 -13.1(17) .
C54 C55 C59 C60 173.3(12) .
C56 C55 C59 C62 -134.8(11) .
C54 C55 C59 C62 51.6(14) .
C56 C55 C59 C61 106.0(12) .
C54 C55 C59 C61 -67.7(13) .
O7 C63 C64 C65 -179.7(8) .
C68 C63 C64 C65 -5.0(11) .
O7 C63 C64 C74 0.7(13) .
C68 C63 C64 C74 175.4(7) .
C63 C64 C65 C66 3.7(15) .
C74 C64 C65 C66 -176.7(9) .
C64 C65 C66 C67 -2.3(15) .
C64 C65 C66 C70 176.4(11) .
C65 C66 C67 C68 2.8(15) .
C70 C66 C67 C68 -175.8(11) .
C66 C67 C68 C69 178.9(9) .
C66 C67 C68 C63 -4.6(14) .
O7 C63 C68 C67 -179.0(8) .
C64 C63 C68 C67 5.5(11) .
O7 C63 C68 C69 -2.5(11) .
C64 C63 C68 C69 -178.0(7) .
C64 C63 O7 Pd3 -19.0(11) .
C68 C63 O7 Pd3 166.2(5) .
N5 Pd3 O7 C63 18.0(6) .
O9 Pd3 O7 C63 -165.3(6) .
C67 C68 C69 O8 -5.3(14) .
C63 C68 C69 O8 178.3(8) .
C65 C66 C70 C71 171.2(11) .
C67 C66 C70 C71 -10.2(18) .
C65 C66 C70 C73 49.0(16) .
C67 C66 C70 C73 -132.4(13) .
C65 C66 C70 C72 -67.6(15) .
C67 C66 C70 C72 111.0(13) .
N6 Pd3 N5 C78 -11.0(5) .
O7 Pd3 N5 C78 166.4(5) .
N6 Pd3 N5 C74 179.1(6) .
O7 Pd3 N5 C74 -3.5(6) .
C78 N5 C74 C75 -2.4(11) .
Pd3 N5 C74 C75 167.0(5) .
C78 N5 C74 C64 179.7(7) .
Pd3 N5 C74 C64 -10.9(10) .
C63 C64 C74 N5 16.0(12) .
C65 C64 C74 N5 -163.6(8) .
C63 C64 C74 C75 -161.9(8) .
C65 C64 C74 C75 18.5(12) .
N5 C74 C75 C76 4.3(12) .
C64 C74 C75 C76 -177.7(8) .
C74 C75 C76 C77 -2.1(13) .
C75 C76 C77 C78 -2.0(14) .
C74 N5 C78 C77 -1.9(11) .
Pd3 N5 C78 C77 -172.3(6) .
C74 N5 C78 C79 -178.7(6) .
Pd3 N5 C78 C79 10.8(8) .
C76 C77 C78 N5 4.1(13) .
C76 C77 C78 C79 -179.3(8) .
N5 Pd3 N6 C79 9.4(5) .
O9 Pd3 N6 C79 -167.5(5) .
N5 Pd3 N6 C83 -178.9(7) .
O9 Pd3 N6 C83 4.2(6) .
C83 N6 C79 C80 -1.3(12) .
Pd3 N6 C79 C80 170.9(7) .
C83 N6 C79 C78 -178.2(6) .
Pd3 N6 C79 C78 -6.0(8) .
N5 C78 C79 N6 -3.3(9) .
C77 C78 C79 N6 179.9(7) .
N5 C78 C79 C80 179.7(8) .
C77 C78 C79 C80 2.9(12) .
N6 C79 C80 C81 -0.9(14) .
C78 C79 C80 C81 175.7(9) .
C79 C80 C81 C82 0.4(17) .
C80 C81 C82 C83 2.1(17) .
C79 N6 C83 C82 3.8(11) .
Pd3 N6 C83 C82 -167.7(7) .
C79 N6 C83 C86 -171.2(7) .
Pd3 N6 C83 C86 17.3(10) .
C81 C82 C83 N6 -4.2(14) .
C81 C82 C83 C86 170.9(9) .
C93 C84 C85 O9 -177.0(7) .
C94 C84 C85 O9 6.0(10) .
C93 C84 C85 C86 1.8(11) .
C94 C84 C85 C86 -175.3(7) .
O9 C85 C86 C87 179.6(7) .
C84 C85 C86 C87 1.0(11) .
O9 C85 C86 C83 -3.5(12) .
C84 C85 C86 C83 177.9(7) .
N6 C83 C86 C87 154.6(8) .
C82 C83 C86 C87 -20.4(12) .
N6 C83 C86 C85 -22.3(12) .
C82 C83 C86 C85 162.7(8) .
C85 C86 C87 C88 -3.8(12) .
C83 C86 C87 C88 179.2(8) .
C86 C87 C88 C93 3.8(13) .
C86 C87 C88 C89 -179.5(9) .
C93 C88 C89 C90 -1.6(15) .
C87 C88 C89 C90 -178.2(9) .
C88 C89 C90 C91 0.4(17) .
C89 C90 C91 C92 0.4(17) .
C90 C91 C92 C93 0.0(15) .
C87 C88 C93 C84 -0.8(13) .
C89 C88 C93 C84 -177.5(8) .
C87 C88 C93 C92 178.6(8) .
C89 C88 C93 C92 1.9(13) .
C85 C84 C93 C88 -1.8(12) .
C94 C84 C93 C88 175.1(8) .
C85 C84 C93 C92 178.7(8) .
C94 C84 C93 C92 -4.3(12) .
C91 C92 C93 C88 -1.2(13) .
C91 C92 C93 C84 178.3(9) .
C84 C85 O9 Pd3 -151.3(5) .
C86 C85 O9 Pd3 30.0(9) .
N6 Pd3 O9 C85 -27.4(5) .
O7 Pd3 O9 C85 155.4(5) .
C85 C84 C94 C103 -110.2(9) .
C93 C84 C94 C103 72.8(10) .
C85 C84 C94 C95 63.5(9) .
C93 C84 C94 C95 -113.5(9) .
C103 C94 C95 O10 179.4(7) .
C84 C94 C95 O10 5.8(10) .
C103 C94 C95 C96 -3.0(11) .
C84 C94 C95 C96 -176.6(7) .
O10 C95 C96 C97 -177.6(8) .
C94 C95 C96 C97 5.0(11) .
O10 C95 C96 C104 0.7(12) .
C94 C95 C96 C104 -176.7(7) .
C95 C96 C97 C98 -3.8(12) .
C104 C96 C97 C98 177.7(7) .
C96 C97 C98 C103 0.6(12) .
C96 C97 C98 C99 178.3(8) .
C97 C98 C99 C100 -179.7(9) .
C103 C98 C99 C100 -2.0(13) .
C98 C99 C100 C101 0.7(14) .
C99 C100 C101 C102 0.1(15) .
C100 C101 C102 C103 0.6(14) .
C95 C94 C103 C102 -179.0(7) .
C84 C94 C103 C102 -5.5(11) .
C95 C94 C103 C98 -0.1(11) .
C84 C94 C103 C98 173.4(7) .
C101 C102 C103 C94 177.0(8) .
C101 C102 C103 C98 -1.9(11) .
C97 C98 C103 C94 1.4(11) .
C99 C98 C103 C94 -176.3(7) .
C97 C98 C103 C102 -179.7(7) .
C99 C98 C103 C102 2.6(11) .
C94 C95 O10 Pd4 -148.9(5) .
C96 C95 O10 Pd4 33.7(10) .
N7 Pd4 O10 C95 -34.5(5) .
O11 Pd4 O10 C95 149.3(5) .
Pd5 Pd4 O10 C95 -123.0(5) .
N8 Pd4 N7 C104 -174.8(7) .
O10 Pd4 N7 C104 9.6(7) .
Pd5 Pd4 N7 C104 100.9(6) .
N8 Pd4 N7 C108 12.0(6) .
O10 Pd4 N7 C108 -163.5(6) .
Pd5 Pd4 N7 C108 -72.2(6) .
C108 N7 C104 C105 7.5(12) .
Pd4 N7 C104 C105 -165.1(6) .
C108 N7 C104 C96 -170.7(7) .
Pd4 N7 C104 C96 16.7(11) .
C97 C96 C104 N7 150.2(8) .
C95 C96 C104 N7 -28.2(12) .
C97 C96 C104 C105 -27.9(12) .
C95 C96 C104 C105 153.7(8) .
N7 C104 C105 C106 -4.6(14) .
C96 C104 C105 C106 173.5(9) .
C104 C105 C106 C107 -0.5(16) .
C105 C106 C107 C108 2.9(16) .
C104 N7 C108 C107 -5.1(13) .
Pd4 N7 C108 C107 168.4(7) .
C104 N7 C108 C109 173.5(8) .
Pd4 N7 C108 C109 -12.9(10) .
C106 C107 C108 N7 -0.2(14) .
C106 C107 C108 C109 -178.7(10) .
N7 Pd4 N8 C113 173.5(8) .
O11 Pd4 N8 C113 -10.1(8) .
Pd5 Pd4 N8 C113 -97.4(7) .
N7 Pd4 N8 C109 -8.6(6) .
O11 Pd4 N8 C109 167.8(6) .
Pd5 Pd4 N8 C109 80.5(6) .
C113 N8 C109 C110 3.0(15) .
Pd4 N8 C109 C110 -175.0(8) .
C113 N8 C109 C108 -178.0(8) .
Pd4 N8 C109 C108 4.0(10) .
N7 C108 C109 C110 -175.1(10) .
C107 C108 C109 C110 3.5(16) .
N7 C108 C109 N8 5.9(12) .
C107 C108 C109 N8 -175.5(9) .
N8 C109 C110 C111 -0.4(17) .
C108 C109 C110 C111 -179.4(11) .
C109 C110 C111 C112 1.2(18) .
C110 C111 C112 C113 -4.3(18) .
C109 N8 C113 C112 -6.0(14) .
Pd4 N8 C113 C112 171.6(7) .
C109 N8 C113 C115 -179.3(8) .
Pd4 N8 C113 C115 -1.7(13) .
C111 C112 C113 N8 6.8(16) .
C111 C112 C113 C115 -179.9(10) .
O11 C114 C115 C116 175.4(8) .
C119 C114 C115 C116 -6.7(12) .
O11 C114 C115 C113 -3.6(15) .
C119 C114 C115 C113 174.3(8) .
N8 C113 C115 C114 11.8(14) .
C112 C113 C115 C114 -161.4(10) .
N8 C113 C115 C116 -167.3(9) .
C112 C113 C115 C116 19.6(13) .
C114 C115 C116 C117 6.3(14) .
C113 C115 C116 C117 -174.6(9) .
C115 C116 C117 C118 -3.3(15) .
C115 C116 C117 C121 173.7(9) .
C116 C117 C118 C119 1.0(14) .
C121 C117 C118 C119 -175.7(9) .
C117 C118 C119 C114 -1.8(13) .
C117 C118 C119 C120 174.6(9) .
O11 C114 C119 C118 -177.1(7) .
C115 C114 C119 C118 4.7(12) .
O11 C114 C119 C120 6.4(11) .
C115 C114 C119 C120 -171.8(8) .
C115 C114 O11 Pd4 -13.0(11) .
C119 C114 O11 Pd4 169.1(5) .
N8 Pd4 O11 C114 16.6(6) .
O10 Pd4 O11 C114 -168.1(5) .
Pd5 Pd4 O11 C114 100.5(5) .
C118 C119 C120 O12 0.8(13) .
C114 C119 C120 O12 177.3(8) .
C118 C117 C121 C123 102.7(17) .
C116 C117 C121 C123 -74.0(18) .
C118 C117 C121 C122 -23.0(16) .
C116 C117 C121 C122 160.3(10) .
C118 C117 C121 C124 -138.3(13) .
C116 C117 C121 C124 44.9(15) .
N7 Pd4 Pd5 N9 -137.8(3) .
N8 Pd4 Pd5 N9 137.9(4) .
O11 Pd4 Pd5 N9 43.3(3) .
O10 Pd4 Pd5 N9 -45.4(3) .
N7 Pd4 Pd5 O15 37.8(3) .
N8 Pd4 Pd5 O15 -46.6(4) .
O11 Pd4 Pd5 O15 -141.2(3) .
O10 Pd4 Pd5 O15 130.1(3) .
N7 Pd4 Pd5 O13 125.5(3) .
N8 Pd4 Pd5 O13 41.2(3) .
O11 Pd4 Pd5 O13 -53.4(3) .
O10 Pd4 Pd5 O13 -142.2(3) .
N7 Pd4 Pd5 N10 -55.7(4) .
N8 Pd4 Pd5 N10 -140.0(4) .
O11 Pd4 Pd5 N10 125.4(4) .
O10 Pd4 Pd5 N10 36.6(3) .
O13 C125 C126 C127 174.9(12) .
C130 C125 C126 C127 1.6(16) .
O13 C125 C126 C136 -15(2) .
C130 C125 C126 C136 171.4(12) .
C125 C126 C127 C128 -1.7(19) .
C136 C126 C127 C128 -172.3(14) .
C126 C127 C128 C129 2(2) .
C126 C127 C128 C132 179.5(12) .
C127 C128 C129 C130 -1(2) .
C132 C128 C129 C130 -179.0(13) .
C128 C129 C130 C125 1(2) .
C128 C129 C130 C131 -179.5(13) .
O13 C125 C130 C129 -175.5(12) .
C126 C125 C130 C129 -1.5(19) .
O13 C125 C130 C131 5.3(16) .
C126 C125 C130 C131 179.3(11) .
C130 C125 O13 Pd5 167.7(9) .
C126 C125 O13 Pd5 -5.6(17) .
N9 Pd5 O13 C125 14.3(10) .
O15 Pd5 O13 C125 -169.9(10) .
Pd4 Pd5 O13 C125 97.5(9) .
C129 C130 C131 O14 -7(2) .
C125 C130 C131 O14 172.6(13) .
C129 C128 C132 C134 -24(2) .
C127 C128 C132 C134 158.2(15) .
C129 C128 C132 C133 89.2(19) .
C127 C128 C132 C133 -88.6(18) .
C129 C128 C132 C135 -148.4(15) .
C127 C128 C132 C135 33.8(18) .
O13 Pd5 N9 C136 -7.6(12) .
N10 Pd5 N9 C136 173.3(13) .
Pd4 Pd5 N9 C136 -91.0(12) .
O13 Pd5 N9 C140 164.7(9) .
N10 Pd5 N9 C140 -14.4(10) .
Pd4 Pd5 N9 C140 81.3(9) .
C140 N9 C136 C126 -179.9(12) .
Pd5 N9 C136 C126 -8(2) .
C140 N9 C136 C137 -0(2) .
Pd5 N9 C136 C137 171.2(10) .
C125 C126 C136 N9 23(2) .
C127 C126 C136 N9 -167.4(13) .
C125 C126 C136 C137 -156.5(13) .
C127 C126 C136 C137 13(2) .
N9 C136 C137 C138 1(2) .
C126 C136 C137 C138 -179.0(13) .
C136 C137 C138 C139 0(2) .
C137 C138 C139 C140 -3(2) .
C136 N9 C140 C139 -3(2) .
Pd5 N9 C140 C139 -174.9(10) .
C136 N9 C140 C141 -177.9(13) .
Pd5 N9 C140 C141 9.7(14) .
C138 C139 C140 N9 4(2) .
C138 C139 C140 C141 179.3(13) .
N9 Pd5 N10 C145 -177.7(16) .
O15 Pd5 N10 C145 6.4(16) .
Pd4 Pd5 N10 C145 99.1(15) .
N9 Pd5 N10 C141 16.1(11) .
O15 Pd5 N10 C141 -159.7(11) .
Pd4 Pd5 N10 C141 -67.0(11) .
C145 N10 C141 C142 -0(2) .
Pd5 N10 C141 C142 166.3(11) .
C145 N10 C141 C140 177.8(16) .
Pd5 N10 C141 C140 -15.6(16) .
N9 C140 C141 C142 -177.9(14) .
C139 C140 C141 C142 7(2) .
N9 C140 C141 N10 4.2(18) .
C139 C140 C141 N10 -170.9(14) .
N10 C141 C142 C143 -7(2) .
C140 C141 C142 C143 175.1(14) .
C141 C142 C143 C144 6(2) .
C142 C143 C144 C145 1(3) .
C141 N10 C145 C144 8(3) .
Pd5 N10 C145 C144 -156.7(13) .
C141 N10 C145 C169 -173.7(14) .
Pd5 N10 C145 C169 22(2) .
C143 C144 C145 N10 -8(3) .
C143 C144 C145 C169 173.2(15) .
O13 Pd5 O15 C168 143.3(7) .
N10 Pd5 O15 C168 -37.7(8) .
Pd4 Pd5 O15 C168 -132.6(7) .
O16 C146 C147 C148 172(2) .
C151 C146 C147 C148 -10(3) .
O16 C146 C147 C157 -2(4) .
C151 C146 C147 C157 175(2) .
C146 C147 C148 C149 10(4) .
C157 C147 C148 C149 -175(2) .
C147 C148 C149 C150 -2(4) .
C147 C148 C149 C153 174(2) .
C148 C149 C150 C151 -5(4) .
C153 C149 C150 C151 -180(2) .
C149 C150 C151 C146 4(4) .
C149 C150 C151 C152 172(3) .
O16 C146 C151 C150 -178(2) .
C147 C146 C151 C150 4(4) .
O16 C146 C151 C152 14(3) .
C147 C146 C151 C152 -164(2) .
C151 C146 O16 Pd6 165.6(18) .
C147 C146 O16 Pd6 -17(4) .
O18 Pd6 O16 C146 -166(2) .
N11 Pd6 O16 C146 18(2) .
C150 C151 C152 O17 13(4) .
C146 C151 C152 O17 -178(3) .
C150 C149 C153 C155 -43(4) .
C148 C149 C153 C155 141(3) .
C150 C149 C153 C154 70(3) .
C148 C149 C153 C154 -106(3) .
C150 C149 C153 C156 -170(3) .
C148 C149 C153 C156 14(3) .
O16 Pd6 N11 C157 -5(2) .
N12 Pd6 N11 C157 -176(3) .
O16 Pd6 N11 C161 169.6(19) .
N12 Pd6 N11 C161 -2(2) .
C161 N11 C157 C147 176(3) .
Pd6 N11 C157 C147 -10(4) .
C161 N11 C157 C158 3(4) .
Pd6 N11 C157 C158 177(2) .
C146 C147 C157 N11 17(4) .
C148 C147 C157 N11 -157(3) .
C146 C147 C157 C158 -170(2) .
C148 C147 C157 C158 15(4) .
N11 C157 C158 C159 1(4) .
C147 C157 C158 C159 -172(3) .
C157 C158 C159 C160 -9(4) .
C158 C159 C160 C161 14(4) .
C157 N11 C161 C160 1(4) .
Pd6 N11 C161 C160 -174(2) .
C157 N11 C161 C162 175(3) .
Pd6 N11 C161 C162 1(3) .
C159 C160 C161 N11 -9(4) .
C159 C160 C161 C162 177(3) .
O18 Pd6 N12 C166 9(3) .
N11 Pd6 N12 C166 -174(3) .
O18 Pd6 N12 C162 -175(2) .
N11 Pd6 N12 C162 2(2) .
N11 C161 C162 C163 -168(3) .
C160 C161 C162 C163 6(5) .
N11 C161 C162 N12 1(4) .
C160 C161 C162 N12 175(3) .
C166 N12 C162 C163 -15(5) .
Pd6 N12 C162 C163 168(2) .
C166 N12 C162 C161 174(3) .
Pd6 N12 C162 C161 -2(3) .
C161 C162 C163 C164 -179(3) .
N12 C162 C163 C164 12(4) .
C162 C163 C164 C165 -2(5) .
C163 C164 C165 C166 -6(5) .
C162 N12 C166 C169 -157(3) .
Pd6 N12 C166 C169 19(5) .
C162 N12 C166 C165 8(6) .
Pd6 N12 C166 C165 -177(3) .
C164 C165 C166 N12 3(6) .
C164 C165 C166 C169 168(3) .
O16 Pd6 O18 C168 164.7(18) .
N12 Pd6 O18 C168 -24.3(19) .
Pd6 O18 C168 O15 100(4) .
Pd6 O18 C168 C167 -155.3(11) .
Pd6 O18 C168 C169 13(2) .
Pd5 O15 C168 O18 -62(3) .
Pd5 O15 C168 C167 -145.5(7) .
Pd5 O15 C168 C169 41.6(11) .
C176 C167 C168 O18 168.7(13) .
C177 C167 C168 O18 -7.9(17) .
C176 C167 C168 O15 -173.7(8) .
C177 C167 C168 O15 9.8(13) .
C176 C167 C168 C169 -0.4(13) .
C177 C167 C168 C169 -176.9(9) .
N12 C166 C169 C170 154(3) .
C165 C166 C169 C170 -11(4) .
N12 C166 C169 C168 -41(4) .
C165 C166 C169 C168 154(3) .
N12 C166 C169 C145 35(7) .
C165 C166 C169 C145 -129(13) .
O18 C168 C169 C166 25(3) .
O15 C168 C169 C166 5(2) .
C167 C168 C169 C166 -167(2) .
O18 C168 C169 C170 -171.5(15) .
O15 C168 C169 C170 169.2(8) .
C167 C168 C169 C170 -3.7(13) .
O18 C168 C169 C145 13(2) .
O15 C168 C169 C145 -6.3(15) .
C167 C168 C169 C145 -179.1(10) .
N10 C145 C169 C166 -138(11) .
C144 C145 C169 C166 40(9) .
N10 C145 C169 C170 156.0(14) .
C144 C145 C169 C170 -26(2) .
N10 C145 C169 C168 -28(2) .
C144 C145 C169 C168 150.0(14) .
C166 C169 C170 C171 172.2(19) .
C168 C169 C170 C171 6.4(14) .
C145 C169 C170 C171 -177.9(10) .
C169 C170 C171 C176 -4.9(14) .
C169 C170 C171 C172 174.3(9) .
C170 C171 C172 C173 179.4(11) .
C176 C171 C172 C173 -1.4(16) .
C171 C172 C173 C174 5(2) .
C172 C173 C174 C175 -6(2) .
C173 C174 C175 C176 2.8(19) .
C170 C171 C176 C175 177.4(9) .
C172 C171 C176 C175 -1.8(15) .
C170 C171 C176 C167 0.8(14) .
C172 C171 C176 C167 -178.3(9) .
C174 C175 C176 C171 1.1(16) .
C174 C175 C176 C167 177.6(10) .
C168 C167 C176 C171 1.8(14) .
C177 C167 C176 C171 178.2(10) .
C168 C167 C176 C175 -174.6(9) .
C177 C167 C176 C175 1.8(16) .
C168 C167 C177 C186 -111.1(11) .
C176 C167 C177 C186 72.4(13) .
C168 C167 C177 C178 66.4(12) .
C176 C167 C177 C178 -110.1(10) .
C186 C177 C178 O19 -176.7(8) .
C167 C177 C178 O19 5.8(12) .
C186 C177 C178 C179 3.6(13) .
C167 C177 C178 C179 -173.9(8) .
O19 C178 C179 C180 178.4(9) .
C177 C178 C179 C180 -1.9(13) .
O19 C178 C179 C187 -0.8(13) .
C177 C178 C179 C187 179.0(8) .
C178 C179 C180 C181 1.4(16) .
C187 C179 C180 C181 -179.4(10) .
C179 C180 C181 C182 -179.4(12) .
C179 C180 C181 C186 -2.5(17) .
C186 C181 C182 C183 8(2) .
C180 C181 C182 C183 -175.3(14) .
C181 C182 C183 C184 -10(2) .
C182 C183 C184 C185 7(2) .
C183 C184 C185 C186 -2(2) .
C184 C185 C186 C177 176.2(11) .
C184 C185 C186 C181 -0.2(17) .
C178 C177 C186 C185 179.0(9) .
C167 C177 C186 C185 -3.6(15) .
C178 C177 C186 C181 -4.6(14) .
C167 C177 C186 C181 172.8(9) .
C182 C181 C186 C185 -2.5(17) .
C180 C181 C186 C185 -179.5(10) .
C182 C181 C186 C177 -179.0(11) .
C180 C181 C186 C177 4.0(16) .
C177 C178 O19 Pd7 -146.8(6) .
C179 C178 O19 Pd7 32.9(11) .
O20 Pd7 O19 C178 151.0(6) .
N13 Pd7 O19 C178 -33.1(7) .
O19 Pd7 N13 C191 -164.9(6) .
N14 Pd7 N13 C191 10.4(6) .
O19 Pd7 N13 C187 7.8(7) .
N14 Pd7 N13 C187 -176.9(7) .
C191 N13 C187 C188 3.0(13) .
Pd7 N13 C187 C188 -169.0(7) .
C191 N13 C187 C179 -172.0(8) .
Pd7 N13 C187 C179 16.0(11) .
C180 C179 C187 N13 155.8(9) .
C178 C179 C187 N13 -25.0(13) .
C180 C179 C187 C188 -19.1(14) .
C178 C179 C187 C188 160.0(9) .
N13 C187 C188 C189 1.4(14) .
C179 C187 C188 C189 176.5(9) .
C187 C188 C189 C190 -4.8(16) .
C188 C189 C190 C191 3.7(15) .
C187 N13 C191 C190 -4.1(13) .
Pd7 N13 C191 C190 168.7(7) .
C187 N13 C191 C192 178.4(7) .
Pd7 N13 C191 C192 -8.7(9) .
C189 C190 C191 N13 0.8(13) .
C189 C190 C191 C192 178.1(8) .
O20 Pd7 N14 C196 -4.7(6) .
N13 Pd7 N14 C196 179.3(6) .
O20 Pd7 N14 C192 166.2(5) .
N13 Pd7 N14 C192 -9.7(5) .
C196 N14 C192 C193 -0.4(11) .
Pd7 N14 C192 C193 -171.6(6) .
C196 N14 C192 C191 179.1(7) .
Pd7 N14 C192 C191 7.9(8) .
N13 C191 C192 N14 0.4(11) .
C190 C191 C192 N14 -177.1(7) .
N13 C191 C192 C193 179.9(8) .
C190 C191 C192 C193 2.4(13) .
N14 C192 C193 C194 0.9(12) .
C191 C192 C193 C194 -178.6(8) .
C192 C193 C194 C195 1.5(13) .
C193 C194 C195 C196 -4.4(13) .
C192 N14 C196 C195 -2.3(11) .
Pd7 N14 C196 C195 167.5(5) .
C192 N14 C196 C198 177.5(7) .
Pd7 N14 C196 C198 -12.7(10) .
C194 C195 C196 N14 4.6(12) .
C194 C195 C196 C198 -175.1(8) .
O20 C197 C198 C199 178.7(8) .
C202 C197 C198 C199 -3.9(11) .
O20 C197 C198 C196 -3.2(13) .
C202 C197 C198 C196 174.2(7) .
N14 C196 C198 C199 -161.5(7) .
C195 C196 C198 C199 18.2(12) .
N14 C196 C198 C197 20.3(12) .
C195 C196 C198 C197 -160.0(8) .
C197 C198 C199 C200 1.5(12) .
C196 C198 C199 C200 -176.7(7) .
C198 C199 C200 C201 1.4(13) .
C198 C199 C200 C204 178.0(8) .
C199 C200 C201 C202 -1.8(13) .
C204 C200 C201 C202 -178.3(9) .
C200 C201 C202 C197 -0.8(13) .
C200 C201 C202 C203 179.6(8) .
O20 C197 C202 C201 -178.7(7) .
C198 C197 C202 C201 3.6(11) .
O20 C197 C202 C203 1.0(11) .
C198 C197 C202 C203 -176.7(7) .
C202 C197 O20 Pd7 163.7(5) .
C198 C197 O20 Pd7 -18.9(10) .
O19 Pd7 O20 C197 -165.2(6) .
N14 Pd7 O20 C197 19.7(6) .
C201 C202 C203 O21 -1.1(14) .
C197 C202 C203 O21 179.2(9) .
C201 C200 C204 C205 -26.1(14) .
C199 C200 C204 C205 157.5(9) .
C201 C200 C204 C206 94.8(12) .
C199 C200 C204 C206 -81.5(12) .
C201 C200 C204 C207 -143.4(11) .
C199 C200 C204 C207 40.2(13) .
O22 C208 C209 C219 -3.1(14) .
C213 C208 C209 C219 176.9(8) .
O22 C208 C209 C210 178.2(7) .
C213 C208 C209 C210 -1.8(11) .
C208 C209 C210 C211 3.5(14) .
C219 C209 C210 C211 -175.3(9) .
C209 C210 C211 C212 -2.7(15) .
C209 C210 C211 C215 176.0(9) .
C210 C211 C212 C213 0.3(15) .
C215 C211 C212 C213 -178.4(9) .
C211 C212 C213 C214 178.4(9) .
C211 C212 C213 C208 1.1(14) .
O22 C208 C213 C214 2.6(11) .
C209 C208 C213 C214 -177.4(8) .
O22 C208 C213 C212 179.7(7) .
C209 C208 C213 C212 -0.3(12) .
C209 C208 O22 Pd8 -12.4(10) .
C213 C208 O22 Pd8 167.6(5) .
O24 Pd8 O22 C208 -170.1(5) .
N15 Pd8 O22 C208 14.2(5) .
C212 C213 C214 O23 3.4(14) .
C208 C213 C214 O23 -179.5(9) .
C212 C211 C215 C217 116.4(14) .
C210 C211 C215 C217 -62.3(14) .
C212 C211 C215 C216 -6.4(15) .
C210 C211 C215 C216 175.0(11) .
C212 C211 C215 C218 -128.5(15) .
C210 C211 C215 C218 52.8(17) .
O22 Pd8 N15 C219 -6.5(6) .
N16 Pd8 N15 C219 176.6(7) .
O22 Pd8 N15 C223 167.9(5) .
N16 Pd8 N15 C223 -9.1(5) .
C223 N15 C219 C209 -179.4(8) .
Pd8 N15 C219 C209 -5.7(11) .
C223 N15 C219 C220 -3.6(11) .
Pd8 N15 C219 C220 170.1(6) .
C208 C209 C219 N15 13.1(13) .
C210 C209 C219 N15 -168.2(8) .
C208 C209 C219 C220 -162.5(8) .
C210 C209 C219 C220 16.2(12) .
N15 C219 C220 C221 4.1(13) .
C209 C219 C220 C221 -179.9(9) .
C219 C220 C221 C222 -1.9(14) .
C220 C221 C222 C223 -1.1(14) .
C219 N15 C223 C222 0.8(12) .
Pd8 N15 C223 C222 -173.7(6) .
C219 N15 C223 C224 -179.2(7) .
Pd8 N15 C223 C224 6.3(8) .
C221 C222 C223 N15 1.7(12) .
C221 C222 C223 C224 -178.3(8) .
O24 Pd8 N16 C228 4.1(6) .
N15 Pd8 N16 C228 179.9(6) .
O24 Pd8 N16 C224 -165.6(5) .
N15 Pd8 N16 C224 10.2(5) .
C228 N16 C224 C225 0.9(12) .
Pd8 N16 C224 C225 170.9(6) .
C228 N16 C224 C223 -179.4(7) .
Pd8 N16 C224 C223 -9.4(8) .
N15 C223 C224 C225 -178.2(8) .
C222 C223 C224 C225 1.8(13) .
N15 C223 C224 N16 2.1(10) .
C222 C223 C224 N16 -177.9(7) .
N16 C224 C225 C226 -2.1(13) .
C223 C224 C225 C226 178.2(9) .
C224 C225 C226 C227 2.2(15) .
C225 C226 C227 C228 -1.1(15) .
C224 N16 C228 C227 0.2(12) .
Pd8 N16 C228 C227 -168.4(6) .
C224 N16 C228 C231 -174.3(7) .
Pd8 N16 C228 C231 17.1(10) .
C226 C227 C228 N16 -0.1(13) .
C226 C227 C228 C231 174.2(9) .
C238 C229 C230 O24 -175.9(6) .
C239 C229 C230 O24 7.4(9) .
C238 C229 C230 C231 2.9(10) .
C239 C229 C230 C231 -173.7(6) .
O24 C230 C231 C232 176.9(6) .
C229 C230 C231 C232 -1.8(10) .
O24 C230 C231 C228 -5.4(11) .
C229 C230 C231 C228 175.8(7) .
N16 C228 C231 C232 156.2(7) .
C227 C228 C231 C232 -17.9(12) .
N16 C228 C231 C230 -21.5(12) .
C227 C228 C231 C230 164.4(8) .
C230 C231 C232 C233 -1.0(11) .
C228 C231 C232 C233 -178.8(8) .
C231 C232 C233 C238 2.8(12) .
C231 C232 C233 C234 180.0(8) .
C232 C233 C234 C235 -174.9(9) .
C238 C233 C234 C235 2.3(13) .
C233 C234 C235 C236 -1.4(16) .
C234 C235 C236 C237 0.1(16) .
C235 C236 C237 C238 0.2(15) .
C232 C233 C238 C229 -1.7(12) .
C234 C233 C238 C229 -179.0(7) .
C232 C233 C238 C237 175.3(8) .
C234 C233 C238 C237 -1.9(12) .
C230 C229 C238 C233 -1.1(11) .
C239 C229 C238 C233 175.3(7) .
C230 C229 C238 C237 -178.1(7) .
C239 C229 C238 C237 -1.7(12) .
C236 C237 C238 C233 0.7(13) .
C236 C237 C238 C229 177.7(8) .
C229 C230 O24 Pd8 -148.4(5) .
C231 C230 O24 Pd8 32.8(9) .
O22 Pd8 O24 C230 154.4(5) .
N16 Pd8 O24 C230 -28.7(5) .
C238 C229 C239 C240 -111.6(8) .
C230 C229 C239 C240 65.0(8) .
C238 C229 C239 C248 67.4(10) .
C230 C229 C239 C248 -116.0(7) .
C248 C239 C240 O25 -172.6(7) .
C229 C239 C240 O25 6.4(10) .
C248 C239 C240 O28 178(2) .
C229 C239 C240 O28 -3(2) .
C248 C239 C240 C241 4.0(10) .
C229 C239 C240 C241 -177.0(6) .
O25 C240 C241 C242 174.4(8) .
C239 C240 C241 C242 -1.9(10) .
O28 C240 C241 C242 -175(2) .
O25 C240 C241 C249 -7.5(13) .
C239 C240 C241 C249 176.1(8) .
O28 C240 C241 C249 3(3) .
O25 C240 C241 C270 -13.6(19) .
C239 C240 C241 C270 170.0(17) .
O28 C240 C241 C270 -3(3) .
C240 C241 C242 C243 -2.4(12) .
C249 C241 C242 C243 179.3(9) .
C270 C241 C242 C243 -173.1(19) .
C241 C242 C243 C244 -180.0(8) .
C241 C242 C243 C248 4.3(12) .
C242 C243 C244 C245 -175.2(9) .
C248 C243 C244 C245 0.3(14) .
C243 C244 C245 C246 -2.2(16) .
C244 C245 C246 C247 2.1(16) .
C245 C246 C247 C248 -0.2(14) .
C244 C243 C248 C247 1.5(11) .
C242 C243 C248 C247 177.4(7) .
C244 C243 C248 C239 -177.9(7) .
C242 C243 C248 C239 -1.9(11) .
C246 C247 C248 C243 -1.5(12) .
C246 C247 C248 C239 177.8(8) .
C240 C239 C248 C243 -2.0(10) .
C229 C239 C248 C243 179.0(7) .
C240 C239 C248 C247 178.7(7) .
C229 C239 C248 C247 -0.3(11) .
C239 C240 O25 Pd9 -144.7(6) .
O28 C240 O25 Pd9 -78(6) .
C241 C240 O25 Pd9 38.8(11) .
O26 Pd9 O25 C240 152.3(8) .
N17 Pd9 O25 C240 -34.0(8) .
Pd11 Pd9 O25 C240 -128.0(8) .
N18 Pd9 N17 C249 -176.2(10) .
O25 Pd9 N17 C249 6.4(10) .
Pd11 Pd9 N17 C249 101.0(9) .
N18 Pd9 N17 C253 14.7(7) .
O25 Pd9 N17 C253 -162.6(8) .
Pd11 Pd9 N17 C253 -68.1(7) .
C253 N17 C249 C250 1.7(17) .
Pd9 N17 C249 C250 -166.4(9) .
C253 N17 C249 C241 -173.3(10) .
Pd9 N17 C249 C241 18.6(15) .
C242 C241 C249 N17 153.9(9) .
C240 C241 C249 N17 -24.2(15) .
C270 C241 C249 N17 2(8) .
C242 C241 C249 C250 -21.0(15) .
C240 C241 C249 C250 161.0(10) .
C270 C241 C249 C250 -173(9) .
N17 C249 C250 C251 -0.5(19) .
C241 C249 C250 C251 174.4(12) .
C249 C250 C251 C252 -2(2) .
C250 C251 C252 C253 4(2) .
C251 C252 C253 N17 -2.5(18) .
C251 C252 C253 C254 -179.1(11) .
C249 N17 C253 C252 -0.2(17) .
Pd9 N17 C253 C252 169.3(10) .
C249 N17 C253 C254 176.6(10) .
Pd9 N17 C253 C254 -13.9(11) .
O26 Pd9 N18 C258 -5.5(10) .
N17 Pd9 N18 C258 -179.2(10) .
Pd11 Pd9 N18 C258 -84.8(9) .
O26 Pd9 N18 C254 161.3(7) .
N17 Pd9 N18 C254 -12.4(7) .
Pd11 Pd9 N18 C254 82.0(7) .
C258 N18 C254 C255 -7.6(16) .
Pd9 N18 C254 C255 -175.8(9) .
C258 N18 C254 C253 176.2(9) .
Pd9 N18 C254 C253 8.0(11) .
C252 C253 C254 C255 4.7(18) .
N17 C253 C254 C255 -172.1(11) .
C252 C253 C254 N18 -179.3(11) .
N17 C253 C254 N18 4.0(13) .
N18 C254 C255 C256 6.7(17) .
C253 C254 C255 C256 -177.5(11) .
C254 C255 C256 C257 -0.3(19) .
C255 C256 C257 C258 -5(2) .
C254 N18 C258 C257 2.3(16) .
Pd9 N18 C258 C257 168.4(9) .
C254 N18 C258 C260 -176.4(9) .
Pd9 N18 C258 C260 -10.4(15) .
C256 C257 C258 N18 4(2) .
C256 C257 C258 C260 -177.3(12) .
O26 C259 C260 C261 -178.8(10) .
C264 C259 C260 C261 -4.4(14) .
O26 C259 C260 C258 -3.0(17) .
C264 C259 C260 C258 171.5(9) .
N18 C258 C260 C261 -166.5(10) .
C257 C258 C260 C261 14.8(16) .
N18 C258 C260 C259 17.7(15) .
C257 C258 C260 C259 -161.0(12) .
C259 C260 C261 C262 -1.2(18) .
C258 C260 C261 C262 -177.2(12) .
C260 C261 C262 C263 4.8(19) .
C260 C261 C262 C266 175.6(11) .
C261 C262 C263 C264 -2.4(17) .
C266 C262 C263 C264 -173.8(11) .
C262 C263 C264 C259 -3.6(18) .
C262 C263 C264 C265 -176.6(11) .
O26 C259 C264 C263 -178.0(10) .
C260 C259 C264 C263 6.9(16) .
O26 C259 C264 C265 -5.2(14) .
C260 C259 C264 C265 179.7(10) .
C264 C259 O26 Pd9 168.5(7) .
C260 C259 O26 Pd9 -17.3(14) .
N18 Pd9 O26 C259 18.6(7) .
O25 Pd9 O26 C259 -164.3(8) .
Pd11 Pd9 O26 C259 100.7(7) .
C263 C264 C265 O27 -7.3(19) .
C259 C264 C265 O27 178.9(13) .
C261 C262 C266 C269 25.2(18) .
C263 C262 C266 C269 -164.1(13) .
C261 C262 C266 C268 -95.6(18) .
C263 C262 C266 C268 75.0(17) .
C261 C262 C266 C267 144.6(14) .
C263 C262 C266 C267 -44.7(17) .
O25 C240 O28 Pd10 95(6) .
C239 C240 O28 Pd10 -148(3) .
C241 C240 O28 Pd10 25(5) .
O29 Pd10 O28 C240 160(4) .
N19 Pd10 O28 C240 -20(4) .
N20 Pd10 N19 C274 6(3) .
O28 Pd10 N19 C274 -170(3) .
N20 Pd10 N19 C270 173(3) .
O28 Pd10 N19 C270 -3(3) .
C274 N19 C270 C271 10(6) .
Pd10 N19 C270 C271 -156(3) .
C274 N19 C270 C241 -170(3) .
Pd10 N19 C270 C241 24(5) .
C242 C241 C270 N19 148(3) .
C240 C241 C270 N19 -23(4) .
C249 C241 C270 N19 180(100) .
C242 C241 C270 C271 -32(4) .
C240 C241 C270 C271 157(3) .
C249 C241 C270 C271 -0(6) .
N19 C270 C271 C272 -14(6) .
C241 C270 C271 C272 166(4) .
C270 C271 C272 C273 8(7) .
C271 C272 C273 C274 1(7) .
C270 N19 C274 C273 -1(6) .
Pd10 N19 C274 C273 166(3) .
C270 N19 C274 C275 179(3) .
Pd10 N19 C274 C275 -13(4) .
C272 C273 C274 N19 -4(6) .
C272 C273 C274 C275 175(4) .
O29 Pd10 N20 C275 -177(2) .
N19 Pd10 N20 C275 4(3) .
O29 Pd10 N20 C279 -18(3) .
N19 Pd10 N20 C279 162(3) .
C279 N20 C275 C276 19(5) .
Pd10 N20 C275 C276 179(3) .
C279 N20 C275 C274 -171(3) .
Pd10 N20 C275 C274 -11(4) .
N19 C274 C275 C276 -174(4) .
C273 C274 C275 C276 6(6) .
N19 C274 C275 N20 16(4) .
C273 C274 C275 N20 -163(4) .
N20 C275 C276 C277 -0(6) .
C274 C275 C276 C277 -169(4) .
C275 C276 C277 C278 -10(7) .
C276 C277 C278 C279 1(7) .
C275 N20 C279 C278 -26(5) .
Pd10 N20 C279 C278 176(3) .
C275 N20 C279 C281 173(3) .
Pd10 N20 C279 C281 16(5) .
C277 C278 C279 N20 17(6) .
C277 C278 C279 C281 177(4) .
O29 C280 C281 C282 164(3) .
C285 C280 C281 C282 -8(5) .
O29 C280 C281 C279 -8(6) .
C285 C280 C281 C279 -180(3) .
N20 C279 C281 C280 -1(5) .
C278 C279 C281 C280 -159(4) .
N20 C279 C281 C282 -173(3) .
C278 C279 C281 C282 28(5) .
C280 C281 C282 C283 14(6) .
C279 C281 C282 C283 -173(4) .
C281 C282 C283 C284 -2(6) .
C281 C282 C283 C287 167(3) .
C282 C283 C284 C285 -14(5) .
C287 C283 C284 C285 176(3) .
C283 C284 C285 C280 21(5) .
C283 C284 C285 C286 -174(3) .
O29 C280 C285 C284 178(3) .
C281 C280 C285 C284 -9(5) .
O29 C280 C285 C286 13(5) .
C281 C280 C285 C286 -174(3) .
C281 C280 O29 Pd10 1(5) .
C285 C280 O29 Pd10 172(2) .
N20 Pd10 O29 C280 10(3) .
O28 Pd10 O29 C280 -174(3) .
C284 C285 C286 O30 9(6) .
C280 C285 C286 O30 175(4) .
C282 C283 C287 C290 29(4) .
C284 C283 C287 C290 -161(3) .
C282 C283 C287 C289 -96(4) .
C284 C283 C287 C289 73(4) .
C282 C283 C287 C288 144(4) .
C284 C283 C287 C288 -46(4) .
O26 Pd9 Pd11 N21 47.9(3) .
N18 Pd9 Pd11 N21 144.1(3) .
N17 Pd9 Pd11 N21 -131.8(3) .
O25 Pd9 Pd11 N21 -38.1(3) .
O26 Pd9 Pd11 O33 -135.6(3) .
N18 Pd9 Pd11 O33 -39.4(3) .
N17 Pd9 Pd11 O33 44.7(3) .
O25 Pd9 Pd11 O33 138.5(3) .
O26 Pd9 Pd11 N22 131.7(3) .
N18 Pd9 Pd11 N22 -132.1(3) .
N17 Pd9 Pd11 N22 -48.0(3) .
O25 Pd9 Pd11 N22 45.8(3) .
O26 Pd9 Pd11 O31 -46.7(3) .
N18 Pd9 Pd11 O31 49.5(3) .
N17 Pd9 Pd11 O31 133.6(3) .
O25 Pd9 Pd11 O31 -132.6(3) .
O31 C291 C292 C293 177.9(7) .
C296 C291 C292 C293 -0.5(11) .
O31 C291 C292 C302 -10.6(13) .
C296 C291 C292 C302 171.0(7) .
C291 C292 C293 C294 -3.1(13) .
C302 C292 C293 C294 -175.4(8) .
C292 C293 C294 C295 7.0(13) .
C292 C293 C294 C298 177.7(8) .
C293 C294 C295 C296 -7.5(14) .
C298 C294 C295 C296 -177.6(9) .
C294 C295 C296 C297 179.8(9) .
C294 C295 C296 C291 4.3(15) .
O31 C291 C296 C295 -178.6(8) .
C292 C291 C296 C295 -0.0(12) .
O31 C291 C296 C297 5.7(10) .
C292 C291 C296 C297 -175.8(7) .
C296 C291 O31 Pd11 165.2(5) .
C292 C291 O31 Pd11 -13.2(10) .
N21 Pd11 O31 C291 17.9(6) .
O33 Pd11 O31 C291 -165.7(5) .
Pd9 Pd11 O31 C291 102.1(5) .
C295 C296 C297 O32 3.8(14) .
C291 C296 C297 O32 179.5(8) .
C295 C294 C298 C301 -143.4(11) .
C293 C294 C298 C301 46.7(13) .
C295 C294 C298 C300 96.2(13) .
C293 C294 C298 C300 -73.8(13) .
C295 C294 C298 C299 -22.0(13) .
C293 C294 C298 C299 168.1(9) .
N22 Pd11 N21 C302 179.0(6) .
O31 Pd11 N21 C302 -4.1(6) .
Pd9 Pd11 N21 C302 -93.0(6) .
N22 Pd11 N21 C306 -14.4(5) .
O31 Pd11 N21 C306 162.5(5) .
Pd9 Pd11 N21 C306 73.6(5) .
C306 N21 C302 C303 3.2(11) .
Pd11 N21 C302 C303 168.8(6) .
C306 N21 C302 C292 -179.4(7) .
Pd11 N21 C302 C292 -13.9(10) .
C293 C292 C302 N21 -163.4(7) .
C291 C292 C302 N21 25.1(12) .
C293 C292 C302 C303 13.8(12) .
C291 C292 C302 C303 -157.8(8) .
N21 C302 C303 C304 -0.7(13) .
C292 C302 C303 C304 -177.9(8) .
C302 C303 C304 C305 0.9(14) .
C303 C304 C305 C306 -3.5(13) .
C304 C305 C306 N21 6.2(12) .
C304 C305 C306 C307 -178.6(8) .
C302 N21 C306 C305 -6.1(11) .
Pd11 N21 C306 C305 -173.6(6) .
C302 N21 C306 C307 178.2(7) .
Pd11 N21 C306 C307 10.7(8) .
N21 Pd11 N22 C311 -175.1(6) .
O33 Pd11 N22 C311 8.3(6) .
Pd9 Pd11 N22 C311 100.3(6) .
N21 Pd11 N22 C307 15.3(5) .
O33 Pd11 N22 C307 -161.3(5) .
Pd9 Pd11 N22 C307 -69.3(5) .
C311 N22 C307 C308 -3.5(10) .
Pd11 N22 C307 C308 166.5(5) .
C311 N22 C307 C306 176.2(7) .
Pd11 N22 C307 C306 -13.9(8) .
C305 C306 C307 N22 -173.2(7) .
N21 C306 C307 N22 2.3(10) .
C305 C306 C307 C308 6.4(13) .
N21 C306 C307 C308 -178.1(7) .
N22 C307 C308 C309 0.4(12) .
C306 C307 C308 C309 -179.2(8) .
C307 C308 C309 C310 1.3(13) .
C308 C309 C310 C311 -0.2(13) .
C307 N22 C311 C310 4.7(11) .
Pd11 N22 C311 C310 -163.7(6) .
C307 N22 C311 C314 -173.4(6) .
Pd11 N22 C311 C314 18.2(10) .
C309 C310 C311 N22 -2.8(12) .
C309 C310 C311 C314 175.4(7) .
C321 C312 C313 O33 -178.9(7) .
C322 C312 C313 O33 6.5(10) .
C321 C312 C313 C314 -1.4(11) .
C322 C312 C313 C314 -176.0(6) .
O33 C313 C314 C315 -177.1(7) .
C312 C313 C314 C315 5.6(10) .
O33 C313 C314 C311 -1.3(11) .
C312 C313 C314 C311 -178.6(7) .
N22 C311 C314 C315 147.9(7) .
C310 C311 C314 C315 -30.2(11) .
N22 C311 C314 C313 -28.0(11) .
C310 C311 C314 C313 153.9(8) .
C313 C314 C315 C316 -5.7(11) .
C311 C314 C315 C316 178.2(7) .
C314 C315 C316 C321 1.5(12) .
C314 C315 C316 C317 178.2(8) .
C315 C316 C317 C318 178.7(9) .
C321 C316 C317 C318 -4.6(14) .
C316 C317 C318 C319 2.4(17) .
C317 C318 C319 C320 -0.4(18) .
C318 C319 C320 C321 0.5(16) .
C313 C312 C321 C316 -2.7(11) .
C322 C312 C321 C316 171.6(7) .
C313 C312 C321 C320 178.6(7) .
C322 C312 C321 C320 -7.0(12) .
C315 C316 C321 C312 2.7(11) .
C317 C316 C321 C312 -174.0(8) .
C315 C316 C321 C320 -178.5(7) .
C317 C316 C321 C320 4.7(12) .
C319 C320 C321 C312 176.0(9) .
C319 C320 C321 C316 -2.7(13) .
C312 C313 O33 Pd11 -147.3(5) .
C314 C313 O33 Pd11 35.4(9) .
N22 Pd11 O33 C313 -34.6(6) .
O31 Pd11 O33 C313 148.6(5) .
Pd9 Pd11 O33 C313 -122.1(5) .
C313 C312 C322 C323 67.1(10) .
C321 C312 C322 C323 -107.5(9) .
C313 C312 C322 C331 -112.7(9) .
C321 C312 C322 C331 72.7(11) .
C331 C322 C323 O34 -176.8(7) .
C312 C322 C323 O34 3.3(11) .
C331 C322 C323 C324 1.6(12) .
C312 C322 C323 C324 -178.3(7) .
O34 C323 C324 C325 177.2(8) .
C322 C323 C324 C325 -1.1(12) .
O34 C323 C324 C332 -5.0(13) .
C322 C323 C324 C332 176.7(8) .
C323 C324 C325 C326 -0.6(14) .
C332 C324 C325 C326 -178.5(8) .
C324 C325 C326 C331 1.7(15) .
C324 C325 C326 C327 178.4(10) .
C331 C326 C327 C328 -0.1(17) .
C325 C326 C327 C328 -176.8(11) .
C326 C327 C328 C329 0.3(18) .
C327 C328 C329 C330 -0.5(19) .
C328 C329 C330 C331 0.4(17) .
C325 C326 C331 C330 176.7(9) .
C327 C326 C331 C330 0.0(14) .
C325 C326 C331 C322 -1.2(14) .
C327 C326 C331 C322 -177.8(9) .
C329 C330 C331 C326 -0.2(14) .
C329 C330 C331 C322 177.7(9) .
C323 C322 C331 C326 -0.4(13) .
C312 C322 C331 C326 179.4(8) .
C323 C322 C331 C330 -178.2(8) .
C312 C322 C331 C330 1.6(13) .
C322 C323 O34 Pd12 -149.7(6) .
C324 C323 O34 Pd12 31.9(10) .
N23 Pd12 O34 C323 -29.0(6) .
O35 Pd12 O34 C323 153.1(5) .
Pd13 Pd12 O34 C323 -121.0(5) .
O34 Pd12 N23 C332 6.2(7) .
N24 Pd12 N23 C332 -177.7(7) .
Pd13 Pd12 N23 C332 101.3(6) .
O34 Pd12 N23 C336 -165.0(5) .
N24 Pd12 N23 C336 11.1(5) .
Pd13 Pd12 N23 C336 -69.9(5) .
C336 N23 C332 C333 2.4(12) .
Pd12 N23 C332 C333 -168.1(7) .
C336 N23 C332 C324 -174.1(7) .
Pd12 N23 C332 C324 15.5(11) .
C325 C324 C332 N23 156.7(8) .
C323 C324 C332 N23 -21.1(12) .
C325 C324 C332 C333 -19.7(12) .
C323 C324 C332 C333 162.5(9) .
N23 C332 C333 C334 -5.1(15) .
C324 C332 C333 C334 171.4(10) .
C332 C333 C334 C335 3.5(18) .
C333 C334 C335 C336 0.8(18) .
C334 C335 C336 N23 -3.5(15) .
C334 C335 C336 C337 -179.5(9) .
C332 N23 C336 C335 1.9(12) .
Pd12 N23 C336 C335 173.6(7) .
C332 N23 C336 C337 178.1(7) .
Pd12 N23 C336 C337 -10.1(8) .
N23 Pd12 N24 C341 177.3(6) .
O35 Pd12 N24 C341 -4.7(6) .
Pd13 Pd12 N24 C341 -90.3(6) .
N23 Pd12 N24 C337 -10.1(5) .
O35 Pd12 N24 C337 167.9(4) .
Pd13 Pd12 N24 C337 82.3(4) .
C341 N24 C337 C338 1.5(10) .
Pd12 N24 C337 C338 -171.6(6) .
C341 N24 C337 C336 -179.6(6) .
Pd12 N24 C337 C336 7.3(7) .
C335 C336 C337 C338 -3.1(13) .
N23 C336 C337 C338 -179.2(7) .
C335 C336 C337 N24 178.0(8) .
N23 C336 C337 N24 1.9(10) .
N24 C337 C338 C339 2.2(12) .
C336 C337 C338 C339 -176.5(8) .
C337 C338 C339 C340 -2.8(13) .
C338 C339 C340 C341 -0.2(14) .
C337 N24 C341 C340 -4.4(10) .
Pd12 N24 C341 C340 167.6(5) .
C337 N24 C341 C343 177.3(6) .
Pd12 N24 C341 C343 -10.6(9) .
C339 C340 C341 N24 3.9(12) .
C339 C340 C341 C343 -177.9(8) .
O35 C342 C343 C344 174.3(6) .
C347 C342 C343 C344 -3.2(10) .
O35 C342 C343 C341 -7.9(11) .
C347 C342 C343 C341 174.5(7) .
N24 C341 C343 C342 20.4(11) .
C340 C341 C343 C342 -157.8(8) .
N24 C341 C343 C344 -161.8(6) .
C340 C341 C343 C344 20.0(10) .
C342 C343 C344 C345 2.3(11) .
C341 C343 C344 C345 -175.7(7) .
C343 C344 C345 C346 1.7(12) .
C343 C344 C345 C349 174.9(7) .
C344 C345 C346 C347 -5.1(12) .
C349 C345 C346 C347 -177.7(8) .
C345 C346 C347 C342 4.4(12) .
C345 C346 C347 C348 -177.3(7) .
O35 C342 C347 C346 -177.8(6) .
C343 C342 C347 C346 0.1(10) .
O35 C342 C347 C348 4.0(9) .
C343 C342 C347 C348 -178.2(6) .
C343 C342 O35 Pd12 -12.4(9) .
C347 C342 O35 Pd12 165.3(4) .
O34 Pd12 O35 C342 -168.0(5) .
N24 Pd12 O35 C342 15.9(5) .
Pd13 Pd12 O35 C342 96.8(5) .
C346 C347 C348 O36 -6.8(12) .
C342 C347 C348 O36 171.4(7) .
C346 C345 C349 C352 -140.6(10) .
C344 C345 C349 C352 46.9(12) .
C346 C345 C349 C351 98.0(11) .
C344 C345 C349 C351 -74.4(10) .
C346 C345 C349 C350 -21.0(13) .
C344 C345 C349 C350 166.6(8) .
N23 Pd12 Pd13 N26 -57.3(3) .
O34 Pd12 Pd13 N26 37.2(3) .
N24 Pd12 Pd13 N26 -141.2(3) .
O35 Pd12 Pd13 N26 123.9(3) .
N23 Pd12 Pd13 O39 35.6(3) .
O34 Pd12 Pd13 O39 130.2(2) .
N24 Pd12 Pd13 O39 -48.3(2) .
O35 Pd12 Pd13 O39 -143.1(2) .
N23 Pd12 Pd13 O37 123.9(2) .
O34 Pd12 Pd13 O37 -141.5(2) .
N24 Pd12 Pd13 O37 40.0(2) .
O35 Pd12 Pd13 O37 -54.8(2) .
N23 Pd12 Pd13 N25 -141.4(3) .
O34 Pd12 Pd13 N25 -46.9(2) .
N24 Pd12 Pd13 N25 134.7(2) .
O35 Pd12 Pd13 N25 39.8(2) .
O37 C353 C354 C355 178.7(6) .
C358 C353 C354 C355 -4.3(10) .
O37 C353 C354 C364 -2.2(11) .
C358 C353 C354 C364 174.8(7) .
C353 C354 C355 C356 2.2(11) .
C364 C354 C355 C356 -177.0(7) .
C354 C355 C356 C357 1.1(11) .
C354 C355 C356 C360 174.8(7) .
C355 C356 C357 C358 -2.3(11) .
C360 C356 C357 C358 -175.8(7) .
O37 C353 C358 C359 0.7(10) .
C354 C353 C358 C359 -176.7(7) .
O37 C353 C358 C357 -179.5(6) .
C354 C353 C358 C357 3.1(10) .
C356 C357 C358 C353 0.3(11) .
C356 C357 C358 C359 -179.9(7) .
C354 C353 O37 Pd13 -16.6(9) .
C358 C353 O37 Pd13 166.2(5) .
O39 Pd13 O37 C353 -166.5(5) .
N25 Pd13 O37 C353 18.4(5) .
Pd12 Pd13 O37 C353 100.5(5) .
C353 C358 C359 O38 175.1(8) .
C357 C358 C359 O38 -4.7(12) .
C357 C356 C360 C363 -136.0(8) .
C355 C356 C360 C363 50.8(10) .
C357 C356 C360 C362 104.4(9) .
C355 C356 C360 C362 -68.9(10) .
C357 C356 C360 C361 -15.3(12) .
C355 C356 C360 C361 171.4(8) .
N26 Pd13 N25 C364 176.5(6) .
O37 Pd13 N25 C364 -6.9(6) .
Pd12 Pd13 N25 C364 -94.4(6) .
N26 Pd13 N25 C368 -10.2(5) .
O37 Pd13 N25 C368 166.4(5) .
Pd12 Pd13 N25 C368 78.9(5) .
C368 N25 C364 C365 -1.7(10) .
Pd13 N25 C364 C365 170.9(5) .
C368 N25 C364 C354 -179.9(6) .
Pd13 N25 C364 C354 -7.3(10) .
C355 C354 C364 N25 -165.5(7) .
C353 C354 C364 N25 15.4(11) .
C355 C354 C364 C365 16.4(10) .
C353 C354 C364 C365 -162.7(7) .
N25 C364 C365 C366 3.1(11) .
C354 C364 C365 C366 -178.7(7) .
C364 C365 C366 C367 -2.4(12) .
C365 C366 C367 C368 0.4(11) .
C364 N25 C368 C367 -0.2(11) .
Pd13 N25 C368 C367 -173.7(6) .
C364 N25 C368 C369 -179.7(6) .
Pd13 N25 C368 C369 6.8(8) .
C366 C367 C368 N25 1.0(11) .
C366 C367 C368 C369 -179.6(7) .
O39 Pd13 N26 C373 11.1(7) .
N25 Pd13 N26 C373 -173.7(7) .
Pd12 Pd13 N26 C373 104.0(7) .
O39 Pd13 N26 C369 -163.4(5) .
N25 Pd13 N26 C369 11.8(5) .
Pd12 Pd13 N26 C369 -70.5(5) .
C373 N26 C369 C370 -5.7(12) .
Pd13 N26 C369 C370 169.2(7) .
C373 N26 C369 C368 173.9(7) .
Pd13 N26 C369 C368 -11.2(8) .
N25 C368 C369 C370 -177.5(8) .
C367 C368 C369 C370 3.0(12) .
N25 C368 C369 N26 2.9(10) .
C367 C368 C369 N26 -176.6(7) .
N26 C369 C370 C371 -1.0(13) .
C368 C369 C370 C371 179.4(8) .
C369 C370 C371 C372 3.0(15) .
C370 C371 C372 C373 1.6(16) .
C369 N26 C373 C372 10.0(12) .
Pd13 N26 C373 C372 -164.1(7) .
C369 N26 C373 C376 -171.8(7) .
Pd13 N26 C373 C376 14.1(11) .
C371 C372 C373 N26 -8.1(14) .
C371 C372 C373 C376 173.8(9) .
C383 C374 C375 O39 -178.0(6) .
C384 C374 C375 O39 3.7(10) .
C383 C374 C375 C376 2.9(11) .
C384 C374 C375 C376 -175.4(6) .
O39 C375 C376 C377 -179.0(7) .
C374 C375 C376 C377 0.0(11) .
O39 C375 C376 C373 1.8(11) .
C374 C375 C376 C373 -179.1(7) .
N26 C373 C376 C377 154.4(8) .
C372 C373 C376 C377 -27.5(12) .
N26 C373 C376 C375 -26.5(12) .
C372 C373 C376 C375 151.6(9) .
C375 C376 C377 C378 -3.0(12) .
C373 C376 C377 C378 176.2(8) .
C376 C377 C378 C379 178.7(8) .
C376 C377 C378 C383 3.0(13) .
C377 C378 C379 C380 -177.6(9) .
C383 C378 C379 C380 -1.8(13) .
C378 C379 C380 C381 -2.6(15) .
C379 C380 C381 C382 4.6(15) .
C380 C381 C382 C383 -2.0(13) .
C375 C374 C383 C382 176.8(7) .
C384 C374 C383 C382 -4.9(11) .
C375 C374 C383 C378 -2.9(11) .
C384 C374 C383 C378 175.4(7) .
C381 C382 C383 C374 177.8(8) .
C381 C382 C383 C378 -2.5(11) .
C377 C378 C383 C374 -0.0(12) .
C379 C378 C383 C374 -176.0(7) .
C377 C378 C383 C382 -179.7(8) .
C379 C378 C383 C382 4.3(12) .
C374 C375 O39 Pd13 -147.5(5) .
C376 C375 O39 Pd13 31.5(9) .
N26 Pd13 O39 C375 -33.3(5) .
O37 Pd13 O39 C375 150.2(5) .
Pd12 Pd13 O39 C375 -121.8(5) .
C375 C374 C384 C393 -107.3(8) .
C383 C374 C384 C393 74.3(10) .
C375 C374 C384 C385 66.1(9) .
C383 C374 C384 C385 -112.2(8) .
C393 C384 C385 O40 178.5(7) .
C374 C384 C385 O40 4.9(10) .
C393 C384 C385 C386 -4.4(10) .
C374 C384 C385 C386 -178.0(6) .
O40 C385 C386 C387 -179.2(7) .
C384 C385 C386 C387 3.9(11) .
O40 C385 C386 C394 0.3(12) .
C384 C385 C386 C394 -176.5(7) .
C385 C386 C387 C388 0.5(12) .
C394 C386 C387 C388 -179.0(7) .
C386 C387 C388 C389 172.9(8) .
C386 C387 C388 C393 -4.5(12) .
C387 C388 C389 C390 -178.8(9) .
C393 C388 C389 C390 -1.4(13) .
C388 C389 C390 C391 -2.8(15) .
C389 C390 C391 C392 5.6(16) .
C390 C391 C392 C393 -3.7(14) .
C385 C384 C393 C388 0.5(11) .
C374 C384 C393 C388 173.7(7) .
C385 C384 C393 C392 -176.0(7) .
C374 C384 C393 C392 -2.8(11) .
C387 C388 C393 C384 4.0(12) .
C389 C388 C393 C384 -173.4(7) .
C387 C388 C393 C392 -179.4(7) .
C389 C388 C393 C392 3.1(12) .
C391 C392 C393 C384 175.8(8) .
C391 C392 C393 C388 -0.7(12) .
C384 C385 O40 Pd14 -152.4(5) .
C386 C385 O40 Pd14 30.7(9) .
O41 Pd14 O40 C385 152.0(6) .
N27 Pd14 O40 C385 -31.1(6) .
Pd15 Pd14 O40 C385 -124.2(5) .
O40 Pd14 N27 C394 8.5(7) .
N28 Pd14 N27 C394 -175.2(7) .
Pd15 Pd14 N27 C394 102.9(6) .
O40 Pd14 N27 C398 -165.7(5) .
N28 Pd14 N27 C398 10.6(5) .
Pd15 Pd14 N27 C398 -71.3(5) .
C398 N27 C394 C395 7.9(11) .
Pd14 N27 C394 C395 -165.8(6) .
C398 N27 C394 C386 -170.5(7) .
Pd14 N27 C394 C386 15.8(11) .
C387 C386 C394 N27 153.6(8) .
C385 C386 C394 N27 -25.9(11) .
C387 C386 C394 C395 -24.7(11) .
C385 C386 C394 C395 155.8(8) .
N27 C394 C395 C396 -4.4(13) .
C386 C394 C395 C396 174.0(8) .
C394 C395 C396 C397 -1.6(15) .
C395 C396 C397 C398 4.1(15) .
C396 C397 C398 N27 -0.7(14) .
C396 C397 C398 C399 179.5(9) .
C394 N27 C398 C397 -5.6(12) .
Pd14 N27 C398 C397 168.9(7) .
C394 N27 C398 C399 174.2(7) .
Pd14 N27 C398 C399 -11.3(8) .
O41 Pd14 N28 C403 -6.5(7) .
N27 Pd14 N28 C403 176.5(7) .
Pd15 Pd14 N28 C403 -89.9(6) .
O41 Pd14 N28 C399 169.5(5) .
N27 Pd14 N28 C399 -7.5(5) .
Pd15 Pd14 N28 C399 86.1(5) .
C403 N28 C399 C400 0.6(12) .
Pd14 N28 C399 C400 -175.6(6) .
C403 N28 C399 C398 179.7(7) .
Pd14 N28 C399 C398 3.4(9) .
C397 C398 C399 N28 -175.0(8) .
N27 C398 C399 N28 5.2(11) .
C397 C398 C399 C400 4.1(13) .
N27 C398 C399 C400 -175.7(7) .
N28 C399 C400 C401 2.3(12) .
C398 C399 C400 C401 -176.8(8) .
C399 C400 C401 C402 -0.1(13) .
C400 C401 C402 C403 -4.7(14) .
C399 N28 C403 C402 -5.4(12) .
Pd14 N28 C403 C402 170.1(6) .
C399 N28 C403 C405 177.9(7) .
Pd14 N28 C403 C405 -6.5(11) .
C401 C402 C403 N28 7.5(13) .
C401 C402 C403 C405 -175.7(8) .
O41 C404 C405 C406 177.1(7) .
C409 C404 C405 C406 -3.7(10) .
O41 C404 C405 C403 -4.1(12) .
C409 C404 C405 C403 175.1(7) .
N28 C403 C405 C406 -166.5(8) .
C402 C403 C405 C406 16.9(11) .
N28 C403 C405 C404 14.8(12) .
C402 C403 C405 C404 -161.8(8) .
C404 C405 C406 C407 1.6(13) .
C403 C405 C406 C407 -177.2(8) .
C405 C406 C407 C408 1.6(13) .
C405 C406 C407 C411 178.1(8) .
C406 C407 C408 C409 -2.6(12) .
C411 C407 C408 C409 -179.1(8) .
C407 C408 C409 C404 0.4(13) .
C407 C408 C409 C410 -179.3(7) .
O41 C404 C409 C408 -178.0(8) .
C405 C404 C409 C408 2.8(12) .
O41 C404 C409 C410 1.8(11) .
C405 C404 C409 C410 -177.4(7) .
C409 C404 O41 Pd14 167.5(5) .
C405 C404 O41 Pd14 -13.4(10) .
O40 Pd14 O41 C404 -167.6(5) .
N28 Pd14 O41 C404 16.1(5) .
Pd15 Pd14 O41 C404 98.0(5) .
C408 C409 C410 O42 -5.6(13) .
C404 C409 C410 O42 174.6(8) .
C406 C407 C411 C413 -74.1(13) .
C408 C407 C411 C413 102.1(12) .
C406 C407 C411 C414 46.6(13) .
C408 C407 C411 C414 -137.2(10) .
C406 C407 C411 C412 166.4(9) .
C408 C407 C411 C412 -17.4(13) .
O41 Pd14 Pd15 N30 128.8(3) .
N27 Pd14 Pd15 N30 -53.0(3) .
O40 Pd14 Pd15 N30 40.0(3) .
N28 Pd14 Pd15 N30 -137.1(3) .
O41 Pd14 Pd15 O45 -138.8(2) .
N27 Pd14 Pd15 O45 39.5(2) .
O40 Pd14 Pd15 O45 132.5(2) .
N28 Pd14 Pd15 O45 -44.7(3) .
O41 Pd14 Pd15 N29 43.9(2) .
N27 Pd14 Pd15 N29 -137.9(3) .
O40 Pd14 Pd15 N29 -44.9(2) .
N28 Pd14 Pd15 N29 138.0(3) .
O41 Pd14 Pd15 O43 -50.7(2) .
N27 Pd14 Pd15 O43 127.5(2) .
O40 Pd14 Pd15 O43 -139.5(2) .
N28 Pd14 Pd15 O43 43.4(3) .
O43 C415 C416 C417 176.9(7) .
C420 C415 C416 C417 -1.4(10) .
O43 C415 C416 C426 -6.4(12) .
C420 C415 C416 C426 175.4(6) .
C415 C416 C417 C418 2.6(12) .
C426 C416 C417 C418 -174.3(7) .
C416 C417 C418 C419 -0.6(12) .
C416 C417 C418 C422 173.9(8) .
C417 C418 C419 C420 -2.6(12) .
C422 C418 C419 C420 -176.9(8) .
C418 C419 C420 C415 3.8(12) .
C418 C419 C420 C421 178.6(8) .
O43 C415 C420 C419 179.8(7) .
C416 C415 C420 C419 -1.7(10) .
O43 C415 C420 C421 5.0(10) .
C416 C415 C420 C421 -176.4(7) .
C416 C415 O43 Pd15 -12.5(10) .
C420 C415 O43 Pd15 165.8(5) .
O45 Pd15 O43 C415 -168.3(5) .
N29 Pd15 O43 C415 15.8(6) .
Pd14 Pd15 O43 C415 99.8(5) .
C419 C420 C421 O44 -1.1(13) .
C415 C420 C421 O44 173.7(8) .
C419 C418 C422 C424 101.2(12) .
C417 C418 C422 C424 -72.7(12) .
C419 C418 C422 C425 -137.5(10) .
C417 C418 C422 C425 48.5(12) .
C419 C418 C422 C423 -21.1(13) .
C417 C418 C422 C423 164.9(9) .
N30 Pd15 N29 C426 177.3(6) .
O43 Pd15 N29 C426 -5.7(6) .
Pd14 Pd15 N29 C426 -94.6(6) .
N30 Pd15 N29 C430 -10.5(5) .
O43 Pd15 N29 C430 166.5(5) .
Pd14 Pd15 N29 C430 77.6(5) .
C430 N29 C426 C427 -0.9(11) .
Pd15 N29 C426 C427 170.5(5) .
C430 N29 C426 C416 179.6(7) .
Pd15 N29 C426 C416 -8.9(10) .
C417 C416 C426 N29 -165.2(7) .
C415 C416 C426 N29 18.0(11) .
C417 C416 C426 C427 15.4(11) .
C415 C416 C426 C427 -161.4(7) .
N29 C426 C427 C428 3.7(12) .
C416 C426 C427 C428 -176.9(7) .
C426 C427 C428 C429 -2.0(13) .
C427 C428 C429 C430 -2.4(13) .
C428 C429 C430 N29 5.2(12) .
C428 C429 C430 C431 -177.9(8) .
C426 N29 C430 C429 -3.5(11) .
Pd15 N29 C430 C429 -176.2(6) .
C426 N29 C430 C431 179.3(7) .
Pd15 N29 C430 C431 6.6(8) .
O45 Pd15 N30 C435 6.0(7) .
N29 Pd15 N30 C435 -178.0(7) .
Pd14 Pd15 N30 C435 97.8(6) .
O45 Pd15 N30 C431 -163.7(5) .
N29 Pd15 N30 C431 12.4(5) .
Pd14 Pd15 N30 C431 -71.9(5) .
C435 N30 C431 C432 -3.6(11) .
Pd15 N30 C431 C432 166.9(6) .
C435 N30 C431 C430 177.4(7) .
Pd15 N30 C431 C430 -12.1(8) .
C429 C430 C431 C432 7.6(13) .
N29 C430 C431 C432 -175.3(8) .
C429 C430 C431 N30 -173.4(7) .
N29 C430 C431 N30 3.6(10) .
N30 C431 C432 C433 0.9(13) .
C430 C431 C432 C433 179.8(9) .
C431 C432 C433 C434 0.1(15) .
C432 C433 C434 C435 1.4(15) .
C431 N30 C435 C434 5.2(12) .
Pd15 N30 C435 C434 -163.6(6) .
C431 N30 C435 C438 -173.3(7) .
Pd15 N30 C435 C438 17.9(10) .
C433 C434 C435 N30 -4.1(13) .
C433 C434 C435 C438 174.3(8) .
C445 C436 C437 O45 -177.3(7) .
C446 C436 C437 O45 5.4(11) .
C445 C436 C437 C438 -1.8(11) .
C446 C436 C437 C438 -179.1(7) .
O45 C437 C438 C439 179.8(7) .
C436 C437 C438 C439 4.4(12) .
O45 C437 C438 C435 -4.0(12) .
C436 C437 C438 C435 -179.4(8) .
N30 C435 C438 C439 152.0(8) .
C434 C435 C438 C439 -26.5(12) .
N30 C435 C438 C437 -24.3(12) .
C434 C435 C438 C437 157.3(8) .
C437 C438 C439 C440 -4.4(13) .
C435 C438 C439 C440 179.0(8) .
C438 C439 C440 C445 1.7(13) .
C438 C439 C440 C441 -179.8(9) .
C439 C440 C441 C442 -177.7(10) .
C445 C440 C441 C442 0.8(15) .
C440 C441 C442 C443 -3.5(18) .
C441 C442 C443 C444 3.6(17) .
C442 C443 C444 C445 -1.1(14) .
C439 C440 C445 C436 1.2(12) .
C441 C440 C445 C436 -177.4(8) .
C439 C440 C445 C444 -179.9(8) .
C441 C440 C445 C444 1.5(12) .
C437 C436 C445 C440 -1.0(12) .
C446 C436 C445 C440 176.1(7) .
C437 C436 C445 C444 -179.9(8) .
C446 C436 C445 C444 -2.8(12) .
C443 C444 C445 C440 -1.4(13) .
C443 C444 C445 C436 177.6(8) .
C436 C437 O45 Pd15 -149.1(6) .
C438 C437 O45 Pd15 35.6(10) .
N30 Pd15 O45 C437 -33.2(6) .
O43 Pd15 O45 C437 149.8(6) .
Pd14 Pd15 O45 C437 -120.9(5) .
C437 C436 C446 C447 66.9(10) .
C445 C436 C446 C447 -110.4(9) .
C437 C436 C446 C455 -110.1(9) .
C445 C436 C446 C455 72.6(10) .
C455 C446 C447 O46 -179.6(7) .
C436 C446 C447 O46 3.3(10) .
C455 C446 C447 C448 -1.7(11) .
C436 C446 C447 C448 -178.8(7) .
O46 C447 C448 C449 -178.8(7) .
C446 C447 C448 C449 3.4(11) .
O46 C447 C448 C456 2.1(12) .
C446 C447 C448 C456 -175.7(7) .
C447 C448 C449 C450 -0.7(12) .
C456 C448 C449 C450 178.5(8) .
C448 C449 C450 C455 -3.8(13) .
C448 C449 C450 C451 175.7(8) .
C449 C450 C451 C452 -178.5(9) .
C455 C450 C451 C452 1.1(14) .
C450 C451 C452 C453 -4.7(15) .
C451 C452 C453 C454 5.3(16) .
C452 C453 C454 C455 -2.1(14) .
C449 C450 C455 C446 5.5(12) .
C451 C450 C455 C446 -174.0(8) .
C449 C450 C455 C454 -178.4(8) .
C451 C450 C455 C454 2.1(12) .
C447 C446 C455 C450 -2.7(12) .
C436 C446 C455 C450 174.2(7) .
C447 C446 C455 C454 -178.7(7) .
C436 C446 C455 C454 -1.8(12) .
C453 C454 C455 C450 -1.6(12) .
C453 C454 C455 C446 174.5(8) .
C446 C447 O46 Pd16 -149.5(5) .
C448 C447 O46 Pd16 32.8(9) .
N31 Pd16 O46 C447 -33.3(5) .
O47 Pd16 O46 C447 150.4(5) .
Pd1 Pd16 O46 C447 -123.4(5) 1_654
N32 Pd16 N31 C456 -176.3(6) .
O46 Pd16 N31 C456 8.2(6) .
Pd1 Pd16 N31 C456 100.3(6) 1_654
N32 Pd16 N31 C460 11.3(5) .
O46 Pd16 N31 C460 -164.2(5) .
Pd1 Pd16 N31 C460 -72.0(5) 1_654
C460 N31 C456 C457 7.9(11) .
Pd16 N31 C456 C457 -163.9(6) .
C460 N31 C456 C448 -169.5(7) .
Pd16 N31 C456 C448 18.7(10) .
C449 C448 C456 N31 150.7(7) .
C447 C448 C456 N31 -30.1(11) .
C449 C448 C456 C457 -26.6(11) .
C447 C448 C456 C457 152.6(8) .
N31 C456 C457 C458 -4.0(13) .
C448 C456 C457 C458 173.4(8) .
C456 C457 C458 C459 -3.7(14) .
C457 C458 C459 C460 7.4(15) .
C456 N31 C460 C459 -4.3(11) .
Pd16 N31 C460 C459 168.6(6) .
C456 N31 C460 C461 176.0(6) .
Pd16 N31 C460 C461 -11.2(8) .
C458 C459 C460 N31 -3.6(13) .
C458 C459 C460 C461 176.1(8) .
N31 Pd16 N32 C465 176.3(5) .
O47 Pd16 N32 C465 -7.4(5) .
Pd1 Pd16 N32 C465 -93.0(5) 1_654
N31 Pd16 N32 C461 -9.5(4) .
O47 Pd16 N32 C461 166.8(4) .
Pd1 Pd16 N32 C461 81.2(4) 1_654
C465 N32 C461 C462 0.6(10) .
Pd16 N32 C461 C462 -173.7(6) .
C465 N32 C461 C460 -179.7(6) .
Pd16 N32 C461 C460 6.0(7) .
N31 C460 C461 C462 -176.9(7) .
C459 C460 C461 C462 3.4(12) .
N31 C460 C461 N32 3.5(9) .
C459 C460 C461 N32 -176.3(7) .
N32 C461 C462 C463 1.9(11) .
C460 C461 C462 C463 -177.7(7) .
C461 C462 C463 C464 -2.4(12) .
C462 C463 C464 C465 0.5(12) .
C461 N32 C465 C467 179.9(6) .
Pd16 N32 C465 C467 -6.5(9) .
C461 N32 C465 C464 -2.4(9) .
Pd16 N32 C465 C464 171.2(5) .
C463 C464 C465 N32 1.8(11) .
C463 C464 C465 C467 179.6(7) .
N32 C465 C467 C468 -165.3(7) .
C464 C465 C467 C468 17.1(11) .
N32 C465 C467 C466 15.0(11) .
C464 C465 C467 C466 -162.5(7) .
O47 C466 C467 C468 177.3(7) .
C471 C466 C467 C468 -4.6(10) .
O47 C466 C467 C465 -3.0(11) .
C471 C466 C467 C465 175.1(7) .
C465 C467 C468 C469 -174.7(8) .
C466 C467 C468 C469 5.0(13) .
C467 C468 C469 C470 -2.3(14) .
C467 C468 C469 C473 175.6(8) .
C468 C469 C470 C471 -1.0(12) .
C473 C469 C470 C471 -178.9(8) .
C469 C470 C471 C466 1.0(11) .
C469 C470 C471 C472 -179.7(7) .
O47 C466 C471 C470 -179.7(6) .
C467 C466 C471 C470 2.0(10) .
O47 C466 C471 C472 1.0(9) .
C467 C466 C471 C472 -177.3(6) .
C471 C466 O47 Pd16 166.8(5) .
C467 C466 O47 Pd16 -15.1(9) .
N32 Pd16 O47 C466 17.5(5) .
O46 Pd16 O47 C466 -167.3(5) .
Pd1 Pd16 O47 C466 100.5(5) 1_654
C470 C471 C472 O48 -3.2(12) .
C466 C471 C472 O48 176.1(7) .
C468 C469 C473 C474 168.3(9) .
C470 C469 C473 C474 -14.0(13) .
C468 C469 C473 C476 47.2(12) .
C470 C469 C473 C476 -135.2(9) .
C468 C469 C473 C475 -70.3(12) .
C470 C469 C473 C475 107.3(10) .
O49 C477 N33 C478 10(3) .
O49 C477 N33 C479 -177.0(17) .
O50 C480 N34 C482 175.5(13) .
O50 C480 N34 C481 -1.6(18) .
O51 C483 N35 C484 -6(3) .
O51 C483 N35 C485 169.8(17) .
O52 C486 N36 C488 -177(2) .
O52 C486 N36 C487 -7(3) .
O53 C489 N37 C490 2(4) .
O53 C489 N37 C491 -179(2) .
O54 C492 N38 C494 178(2) .
O54 C492 N38 C493 -9(3) .
O55 C495 N39 C496 20(4) .
O55 C495 N39 C497 -164(2) .
O56 C498 N40 C500 165(3) .
O56 C498 N40 C499 -33(4) .
O57 C501 N41 C502 -176(2) .
O57 C501 N41 C503 5(2) .
O58 C504 N42 C505 -1(3) .
O58 C504 N42 C506 174(3) .
O59 C507 N43 C509 -172(2) .
O59 C507 N43 C508 -8(3) .
O60 C510 N44 C511 3(3) .
O60 C510 N44 C512 -175(2) .
O61 C513 N45 C514 0(3) .
O61 C513 N45 C515 176(3) .
O62 C516 N46 C518 -175(3) .
O62 C516 N46 C517 2(3) .
O63 C519 N47 C521 173(3) .
O63 C519 N47 C520 3(3) .
O64 C522 N48 C523 0(3) .
O64 C522 N48 C524 -177(2) .
O65 C525 N49 C527 -171(2) .
O65 C525 N49 C526 6(3) .
O66 C528 N50 C529 10(3) .
O66 C528 N50 C530 179(2) .
O67 C531 N51 C532 2(5) .
O67 C531 N51 C533 -174(4) .
O68 C534 N52 C535 -2(3) .
O68 C534 N52 C536 177.8(19) .
O69 C537 N53 C539 174(2) .
O69 C537 N53 C538 -2(2) .
O70 C540 N54 C542 -171(2) .
O70 C540 N54 C541 -2(3) .
O71 C543 N55 C544 2(3) .
O71 C543 N55 C545 -175(3) .
O72 C546 N56 C548 176(2) .
O72 C546 N56 C547 0(3) .
O73 C549 N57 C551 179(3) .
O73 C549 N57 C550 -1(3) .
O74 C552 N58 C554 -173.6(19) .
O74 C552 N58 C553 -1(2) .
O75 C555 N59 C556 -5(3) .
O75 C555 N59 C557 -167(3) .
O76 C558 N60 C559 1(4) .
O76 C558 N60 C560 -176(3) .
O77 C561 N61 C562 -1(3) .
O77 C561 N61 C563 -180(3) .
O78 C564 N62 C565 2(4) .
O78 C564 N62 C566 176(3) .
O79 C567 N63 C569 -175(3) .
O79 C567 N63 C568 1(3) .
O80 C570 N64 C572 177(3) .
O80 C570 N64 C571 2(3) .
O81 C573 N65 C574 1(3) .
O81 C573 N65 C575 179(3) .
O82 C576 N66 C578 -179(3) .
O82 C576 N66 C577 6(3) .
O83 C579 N67 C581 179(3) .
O83 C579 N67 C580 0(3) .
C582 C583 O84 C584 -163.1(18) .
C583 O84 C584 C585 -125(2) .
