#------------------------------------------------------------------------------
#$Date: 2016-03-21 10:56:22 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178674 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/85/4078508.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_4078508
loop_
_publ_author_name
'Li, Yang'
'Wang, Wen-Hua'
'He, Ke-Han'
'Shi, Zhang-Jie'
_publ_section_title
;
 Mechanistic Insight into the Regioselective Palladation of Indole
 Derivatives: Tetranuclear Indolyl Palladacycles with High C2--Pd or
 C3--Pd Bond Selectivity
;
_journal_issue                   12
_journal_name_full               Organometallics
_journal_page_first              4397
_journal_paper_doi               10.1021/om300284t
_journal_volume                  31
_journal_year                    2012
_chemical_formula_sum            'C44 H50 N2 O10 Pd4'
_chemical_formula_weight         1192.46
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                102.2830(10)
_cell_angle_beta                 97.2550(10)
_cell_angle_gamma                113.191(2)
_cell_formula_units_Z            2
_cell_length_a                   12.3044(12)
_cell_length_b                   13.5915(15)
_cell_length_c                   15.5969(18)
_cell_measurement_reflns_used    2119
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      25.374
_cell_measurement_theta_min      2.308
_cell_volume                     2277.7(4)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.977
_diffrn_measured_fraction_theta_max 0.977
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0477
_diffrn_reflns_av_sigmaI/netI    0.1192
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            11832
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         1.89
_exptl_absorpt_coefficient_mu    1.610
_exptl_absorpt_correction_T_max  0.8555
_exptl_absorpt_correction_T_min  0.7183
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            'dark red'
_exptl_crystal_density_diffrn    1.739
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1184
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.988
_refine_diff_density_min         -1.407
_refine_diff_density_rms         0.154
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.050
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     597
_refine_ls_number_reflns         7850
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.050
_refine_ls_R_factor_all          0.1757
_refine_ls_R_factor_gt           0.0803
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0931P)²+15.2309P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1909
_refine_ls_wR_factor_ref         0.2595
_reflns_number_gt                3381
_reflns_number_total             7850
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om300284t_si_002.cif
_cod_data_source_block           9
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4078508
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pd1 Pd -0.03726(11) 0.64029(10) 0.48587(9) 0.0626(4) Uani 1 1 d . . .
Pd2 Pd 0.01968(12) 0.46908(10) 0.37371(9) 0.0644(4) Uani 1 1 d . . .
Pd3 Pd 0.15553(14) 0.48383(13) 0.05587(10) 0.0844(5) Uani 1 1 d . . .
Pd4 Pd -0.04498(14) 0.52163(14) 0.12244(10) 0.0857(5) Uani 1 1 d . . .
N1 N 0.1644(14) 0.8123(13) 0.4123(11) 0.082(4) Uani 1 1 d . . .
N2 N 0.3264(17) 0.6834(15) 0.2311(11) 0.094(5) Uani 1 1 d . . .
O1 O 0.0640(11) 0.7841(10) 0.5810(9) 0.084(3) Uani 1 1 d . . .
O2 O 0.0885(11) 0.7007(11) 0.6869(8) 0.085(4) Uani 1 1 d . . .
O3 O -0.1913(11) 0.6277(10) 0.5373(9) 0.080(3) Uani 1 1 d . . .
O4 O -0.1710(11) 0.5462(10) 0.6442(8) 0.081(3) Uani 1 1 d . . .
O5 O -0.1244(10) 0.4956(9) 0.3922(8) 0.072(3) Uani 1 1 d . . .
O6 O 0.3141(12) 0.5808(12) 0.0339(10) 0.104(4) Uani 1 1 d . . .
O7 O 0.2316(14) 0.5889(13) -0.1003(10) 0.113(5) Uani 1 1 d . . .
O8 O 0.1559(13) 0.3425(13) -0.0284(11) 0.111(5) Uani 1 1 d . . .
O9 O 0.0780(13) 0.3463(13) -0.1659(10) 0.105(5) Uani 1 1 d . . .
O10 O -0.0010(12) 0.3977(12) 0.0814(9) 0.098(4) Uani 1 1 d . . .
C1 C 0.2556(18) 0.8122(16) 0.4703(14) 0.081(5) Uani 1 1 d . . .
C2 C 0.0767(17) 0.7046(16) 0.3826(13) 0.078(5) Uani 1 1 d . . .
H2 H 0.0045 0.6813 0.3404 0.094 Uiso 1 1 calc R . .
C3 C 0.1076(16) 0.6319(15) 0.4233(12) 0.075(5) Uani 1 1 d . . .
C4 C 0.2284(17) 0.7063(15) 0.4794(13) 0.077(5) Uani 1 1 d . . .
C5 C 0.3098(17) 0.6864(16) 0.5370(12) 0.078(5) Uani 1 1 d . . .
H5 H 0.2908 0.6153 0.5431 0.094 Uiso 1 1 calc R . .
C6 C 0.4186(18) 0.7756(18) 0.5843(14) 0.091(6) Uani 1 1 d . . .
H6 H 0.4762 0.7627 0.6188 0.110 Uiso 1 1 calc R . .
C7 C 0.4453(19) 0.8853(19) 0.5819(15) 0.096(6) Uani 1 1 d . . .
H7 H 0.5158 0.9448 0.6192 0.115 Uiso 1 1 calc R . .
C8 C 0.3673(19) 0.9044(17) 0.5245(14) 0.090(6) Uani 1 1 d . . .
H8 H 0.3863 0.9763 0.5204 0.108 Uiso 1 1 calc R . .
C9 C 0.1586(18) 0.9069(17) 0.3897(16) 0.086(6) Uani 1 1 d . . .
C10 C 0.202(2) 0.9431(18) 0.3261(16) 0.102(7) Uani 1 1 d . . .
H10 H 0.2354 0.9044 0.2900 0.122 Uiso 1 1 calc R . .
C11 C 0.200(2) 1.039(2) 0.3103(17) 0.110(7) Uani 1 1 d . . .
H11 H 0.2391 1.0668 0.2675 0.132 Uiso 1 1 calc R . .
C12 C 0.145(2) 1.090(2) 0.3542(19) 0.105(7) Uani 1 1 d . . .
H12 H 0.1305 1.1448 0.3352 0.127 Uiso 1 1 calc R . .
C13 C 0.111(2) 1.063(2) 0.4257(19) 0.117(8) Uani 1 1 d . . .
H13 H 0.0834 1.1059 0.4635 0.140 Uiso 1 1 calc R . .
C14 C 0.117(2) 0.9685(19) 0.4442(16) 0.107(7) Uani 1 1 d . . .
H14 H 0.0915 0.9479 0.4941 0.128 Uiso 1 1 calc R . .
C15 C 0.1074(18) 0.7833(18) 0.6587(15) 0.087(6) Uani 1 1 d . A .
C16 C 0.186(2) 0.9004(18) 0.7294(16) 0.107(7) Uani 1 1 d . . .
H16A H 0.2643 0.9337 0.7159 0.161 Uiso 0.414(19) 1 calc PR A 2
H16B H 0.1967 0.8913 0.7888 0.161 Uiso 0.414(19) 1 calc PR A 2
H16C H 0.1459 0.9478 0.7268 0.161 Uiso 0.414(19) 1 calc PR A 2
C17 C 0.227(3) 0.997(3) 0.688(3) 0.115(14) Uani 0.586(19) 1 d P A 1
H17A H 0.2847 1.0640 0.7328 0.173 Uiso 0.586(19) 1 calc PR A 1
H17B H 0.1579 1.0077 0.6642 0.173 Uiso 0.586(19) 1 calc PR A 1
H17C H 0.2643 0.9801 0.6395 0.173 Uiso 0.586(19) 1 calc PR A 1
C18 C 0.292(4) 0.891(3) 0.784(3) 0.132(16) Uani 0.586(19) 1 d P A 1
H18A H 0.3601 0.9132 0.7559 0.198 Uiso 0.586(19) 1 calc PR A 1
H18B H 0.2682 0.8153 0.7850 0.198 Uiso 0.586(19) 1 calc PR A 1
H18C H 0.3155 0.9392 0.8442 0.198 Uiso 0.586(19) 1 calc PR A 1
C19 C 0.096(4) 0.909(4) 0.788(3) 0.16(2) Uani 0.586(19) 1 d P A 1
H19A H 0.0165 0.8808 0.7502 0.236 Uiso 0.586(19) 1 calc PR A 1
H19B H 0.1223 0.9855 0.8213 0.236 Uiso 0.586(19) 1 calc PR A 1
H19C H 0.0938 0.8653 0.8297 0.236 Uiso 0.586(19) 1 calc PR A 1
C20 C -0.2227(17) 0.5868(16) 0.6011(14) 0.078(5) Uani 1 1 d . A .
C21 C -0.335(2) 0.599(2) 0.6258(17) 0.104(7) Uani 1 1 d . . .
H21A H -0.4063 0.5481 0.5795 0.155 Uiso 0.586(19) 1 calc PR A 1
H21B H -0.3244 0.6744 0.6312 0.155 Uiso 0.586(19) 1 calc PR A 1
H21C H -0.3443 0.5833 0.6822 0.155 Uiso 0.586(19) 1 calc PR A 1
C22 C -0.399(5) 0.653(5) 0.575(4) 0.14(2) Uani 0.414(19) 1 d P A 2
H22A H -0.3552 0.7333 0.5975 0.207 Uiso 0.414(19) 1 calc PR A 2
H22B H -0.4804 0.6306 0.5831 0.207 Uiso 0.414(19) 1 calc PR A 2
H22C H -0.4015 0.6304 0.5117 0.207 Uiso 0.414(19) 1 calc PR A 2
C23 C -0.317(5) 0.642(5) 0.728(4) 0.118(19) Uani 0.414(19) 1 d P A 2
H23A H -0.2616 0.6189 0.7580 0.177 Uiso 0.414(19) 1 calc PR A 2
H23B H -0.3935 0.6112 0.7440 0.177 Uiso 0.414(19) 1 calc PR A 2
H23C H -0.2835 0.7219 0.7462 0.177 Uiso 0.414(19) 1 calc PR A 2
C24 C -0.396(6) 0.472(5) 0.590(4) 0.15(3) Uani 0.414(19) 1 d P A 2
H24A H -0.4044 0.4502 0.5262 0.219 Uiso 0.414(19) 1 calc PR A 2
H24B H -0.4755 0.4443 0.6031 0.219 Uiso 0.414(19) 1 calc PR A 2
H24C H -0.3480 0.4425 0.6190 0.219 Uiso 0.414(19) 1 calc PR A 2
C25 C -0.2131(18) 0.4802(18) 0.3165(14) 0.104(7) Uani 1 1 d . . .
H25A H -0.2458 0.4047 0.2785 0.155 Uiso 1 1 calc R . .
H25B H -0.1762 0.5310 0.2831 0.155 Uiso 1 1 calc R . .
H25C H -0.2774 0.4944 0.3369 0.155 Uiso 1 1 calc R . .
C26 C 0.321(2) 0.7622(19) 0.1906(14) 0.096(6) Uani 1 1 d . . .
C27 C 0.216(2) 0.5960(19) 0.2039(14) 0.094(6) Uani 1 1 d . . .
H27 H 0.1996 0.5305 0.2202 0.113 Uiso 1 1 calc R . .
C28 C 0.1275(19) 0.6109(18) 0.1489(14) 0.095(6) Uani 1 1 d . . .
C29 C 0.201(2) 0.7231(18) 0.1418(14) 0.093(6) Uani 1 1 d . . .
C30 C 0.175(2) 0.7905(19) 0.0949(14) 0.099(6) Uani 1 1 d . . .
H30 H 0.0974 0.7659 0.0601 0.118 Uiso 1 1 calc R . .
C31 C 0.264(2) 0.893(2) 0.0993(15) 0.109(7) Uani 1 1 d . . .
H31 H 0.2463 0.9384 0.0683 0.131 Uiso 1 1 calc R . .
C32 C 0.382(2) 0.930(2) 0.1506(16) 0.108(7) Uani 1 1 d . . .
H32 H 0.4413 1.0003 0.1533 0.130 Uiso 1 1 calc R . .
C33 C 0.413(2) 0.867(2) 0.1965(15) 0.108(7) Uani 1 1 d . . .
H33 H 0.4922 0.8919 0.2301 0.129 Uiso 1 1 calc R . .
C34 C 0.435(2) 0.688(2) 0.2773(17) 0.101(7) Uani 1 1 d . . .
C35 C 0.489(2) 0.628(2) 0.2352(17) 0.113(7) Uani 1 1 d . . .
H35 H 0.4547 0.5854 0.1752 0.136 Uiso 1 1 calc R . .
C36 C 0.595(2) 0.630(2) 0.2813(18) 0.124(8) Uani 1 1 d . . .
H36 H 0.6303 0.5872 0.2532 0.149 Uiso 1 1 calc R . .
C37 C 0.647(2) 0.697(2) 0.3693(18) 0.118(8) Uani 1 1 d . . .
H37 H 0.7186 0.7007 0.4002 0.141 Uiso 1 1 calc R . .
C38 C 0.594(2) 0.758(2) 0.4106(17) 0.110(7) Uani 1 1 d . . .
H38 H 0.6276 0.8017 0.4704 0.132 Uiso 1 1 calc R . .
C39 C 0.491(2) 0.7541(18) 0.3636(16) 0.099(6) Uani 1 1 d . . .
H39 H 0.4565 0.7984 0.3916 0.119 Uiso 1 1 calc R . .
C40 C 0.318(2) 0.613(2) -0.0372(18) 0.108(7) Uani 1 1 d . B .
C41 C 0.446(2) 0.684(3) -0.0463(19) 0.130(9) Uani 1 1 d . . .
H41A H 0.4878 0.7463 0.0068 0.195 Uiso 0.34(2) 1 calc PR B 2
H41B H 0.4402 0.7102 -0.0982 0.195 Uiso 0.34(2) 1 calc PR B 2
H41C H 0.4900 0.6391 -0.0531 0.195 Uiso 0.34(2) 1 calc PR B 2
C42 C 0.484(4) 0.605(4) -0.107(3) 0.159(18) Uani 0.66(2) 1 d P B 1
H42A H 0.4131 0.5402 -0.1439 0.238 Uiso 0.66(2) 1 calc PR B 1
H42B H 0.5342 0.5832 -0.0711 0.238 Uiso 0.66(2) 1 calc PR B 1
H42C H 0.5292 0.6432 -0.1459 0.238 Uiso 0.66(2) 1 calc PR B 1
C43 C 0.446(3) 0.780(3) -0.082(3) 0.142(16) Uani 0.66(2) 1 d P B 1
H43A H 0.5266 0.8392 -0.0652 0.213 Uiso 0.66(2) 1 calc PR B 1
H43B H 0.3923 0.8070 -0.0562 0.213 Uiso 0.66(2) 1 calc PR B 1
H43C H 0.4180 0.7540 -0.1463 0.213 Uiso 0.66(2) 1 calc PR B 1
C44 C 0.526(4) 0.724(4) 0.049(3) 0.17(2) Uani 0.66(2) 1 d P B 1
H44A H 0.4821 0.6809 0.0855 0.260 Uiso 0.66(2) 1 calc PR B 1
H44B H 0.5466 0.8014 0.0752 0.260 Uiso 0.66(2) 1 calc PR B 1
H44C H 0.5986 0.7142 0.0465 0.260 Uiso 0.66(2) 1 calc PR B 1
C45 C 0.119(2) 0.307(2) -0.1170(19) 0.105(7) Uani 1 1 d . B .
C46 C 0.146(3) 0.208(2) -0.1541(19) 0.128(8) Uani 1 1 d . . .
H46A H 0.0706 0.1417 -0.1787 0.192 Uiso 0.66(2) 1 calc PR B 1
H46B H 0.1943 0.1981 -0.1064 0.192 Uiso 0.66(2) 1 calc PR B 1
H46C H 0.1891 0.2214 -0.2007 0.192 Uiso 0.66(2) 1 calc PR B 1
C47 C 0.084(7) 0.124(7) -0.104(5) 0.14(3) Uani 0.34(2) 1 d P B 2
H47A H 0.0553 0.1588 -0.0571 0.212 Uiso 0.34(2) 1 calc PR B 2
H47B H 0.1405 0.1006 -0.0775 0.212 Uiso 0.34(2) 1 calc PR B 2
H47C H 0.0158 0.0603 -0.1454 0.212 Uiso 0.34(2) 1 calc PR B 2
C48 C 0.109(7) 0.157(7) -0.257(5) 0.15(3) Uani 0.34(2) 1 d P B 2
H48A H 0.1436 0.1054 -0.2730 0.222 Uiso 0.34(2) 1 calc PR B 2
H48B H 0.1382 0.2151 -0.2852 0.222 Uiso 0.34(2) 1 calc PR B 2
H48C H 0.0220 0.1179 -0.2759 0.222 Uiso 0.34(2) 1 calc PR B 2
C49 C 0.284(7) 0.262(7) -0.119(5) 0.15(3) Uani 0.34(2) 1 d P B 2
H49A H 0.3050 0.2368 -0.0694 0.222 Uiso 0.34(2) 1 calc PR B 2
H49B H 0.3143 0.3419 -0.1001 0.222 Uiso 0.34(2) 1 calc PR B 2
H49C H 0.3207 0.2414 -0.1669 0.222 Uiso 0.34(2) 1 calc PR B 2
C50 C -0.006(2) 0.322(2) 0.1301(16) 0.131(9) Uani 1 1 d . . .
H50A H -0.0871 0.2857 0.1373 0.196 Uiso 1 1 calc R . .
H50B H 0.0491 0.3616 0.1883 0.196 Uiso 1 1 calc R . .
H50C H 0.0172 0.2678 0.0982 0.196 Uiso 1 1 calc R . .
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_1
_geom_angle_site_symmetry_3
O5 Pd1 O1 174.9(5) . .
O5 Pd1 O3 94.2(5) . .
O1 Pd1 O3 90.2(5) . .
O5 Pd1 C3 78.9(6) . .
O1 Pd1 C3 96.7(6) . .
O3 Pd1 C3 172.9(6) . .
O5 Pd1 C2 87.2(6) . .
O1 Pd1 C2 90.7(6) . .
O3 Pd1 C2 145.5(5) . .
C3 Pd1 C2 36.4(6) . .
O5 Pd1 Pd2 91.8(3) . 2_566
O1 Pd1 Pd2 86.6(4) . 2_566
O3 Pd1 Pd2 77.5(3) . 2_566
C3 Pd1 Pd2 101.4(4) . 2_566
C2 Pd1 Pd2 137.0(4) . 2_566
O5 Pd1 Pd2 41.5(3) . .
O1 Pd1 Pd2 133.5(4) . .
O3 Pd1 Pd2 131.8(3) . .
C3 Pd1 Pd2 41.2(5) . .
C2 Pd1 Pd2 66.5(5) . .
Pd2 Pd1 Pd2 84.90(5) 2_566 .
C3 Pd2 O5 83.6(6) . .
C3 Pd2 O4 92.5(6) . 2_566
O5 Pd2 O4 176.0(5) . 2_566
C3 Pd2 O2 173.7(6) . 2_566
O5 Pd2 O2 91.6(5) . 2_566
O4 Pd2 O2 92.1(5) 2_566 2_566
C3 Pd2 Pd1 110.7(5) . 2_566
O5 Pd2 Pd1 99.4(3) . 2_566
O4 Pd2 Pd1 83.1(3) 2_566 2_566
O2 Pd2 Pd1 74.2(3) 2_566 2_566
C3 Pd2 Pd1 46.8(5) . .
O5 Pd2 Pd1 41.1(3) . .
O4 Pd2 Pd1 135.8(4) 2_566 .
O2 Pd2 Pd1 130.0(4) 2_566 .
Pd1 Pd2 Pd1 95.10(5) 2_566 .
O10 Pd3 O6 176.2(6) . .
O10 Pd3 O8 93.1(6) . .
O6 Pd3 O8 90.6(6) . .
O10 Pd3 C28 77.1(7) . .
O6 Pd3 C28 99.2(7) . .
O8 Pd3 C28 170.1(7) . .
O10 Pd3 C27 87.9(7) . .
O6 Pd3 C27 89.5(7) . .
O8 Pd3 C27 143.8(7) . .
C28 Pd3 C27 36.3(6) . .
O10 Pd3 Pd4 93.8(4) . 2_565
O6 Pd3 Pd4 86.4(4) . 2_565
O8 Pd3 Pd4 76.9(4) . 2_565
C28 Pd3 Pd4 104.7(5) . 2_565
C27 Pd3 Pd4 139.2(5) . 2_565
O10 Pd3 Pd4 41.0(4) . .
O6 Pd3 Pd4 135.3(4) . .
O8 Pd3 Pd4 131.0(4) . .
C28 Pd3 Pd4 40.1(6) . .
C27 Pd3 Pd4 66.9(5) . .
Pd4 Pd3 Pd4 88.24(6) 2_565 .
C28 Pd4 O10 83.2(8) . .
C28 Pd4 O9 93.1(8) . 2_565
O10 Pd4 O9 176.3(6) . 2_565
C28 Pd4 O7 173.8(7) . 2_565
O10 Pd4 O7 92.5(6) . 2_565
O9 Pd4 O7 91.2(6) 2_565 2_565
C28 Pd4 Pd3 109.6(6) . 2_565
O10 Pd4 Pd3 96.5(4) . 2_565
O9 Pd4 Pd3 84.8(5) 2_565 2_565
O7 Pd4 Pd3 75.4(4) 2_565 2_565
C28 Pd4 Pd3 46.9(7) . .
O10 Pd4 Pd3 40.8(4) . .
O9 Pd4 Pd3 135.8(4) 2_565 .
O7 Pd4 Pd3 130.5(5) 2_565 .
Pd3 Pd4 Pd3 91.76(6) 2_565 .
C1 N1 C2 106.1(15) . .
C1 N1 C9 126.9(17) . .
C2 N1 C9 126.9(17) . .
C27 N2 C26 107.2(18) . .
C27 N2 C34 127.7(19) . .
C26 N2 C34 124.0(19) . .
C15 O1 Pd1 119.7(12) . .
C15 O2 Pd2 131.9(13) . 2_566
C20 O3 Pd1 126.5(12) . .
C20 O4 Pd2 125.9(12) . 2_566
C25 O5 Pd1 121.4(11) . .
C25 O5 Pd2 119.9(12) . .
Pd1 O5 Pd2 97.4(5) . .
C40 O6 Pd3 120.9(15) . .
C40 O7 Pd4 129.6(15) . 2_565
C45 O8 Pd3 126.1(16) . .
C45 O9 Pd4 123.4(17) . 2_565
C50 O10 Pd3 117.9(14) . .
C50 O10 Pd4 122.3(14) . .
Pd3 O10 Pd4 98.2(6) . .
N1 C1 C4 111.5(17) . .
N1 C1 C8 129.5(18) . .
C4 C1 C8 118.9(18) . .
N1 C2 C3 112.7(17) . .
N1 C2 Pd1 116.3(13) . .
C3 C2 Pd1 64.7(10) . .
N1 C2 H2 123.6 . .
C3 C2 H2 123.6 . .
Pd1 C2 H2 89.2 . .
C2 C3 C4 102.2(16) . .
C2 C3 Pd2 121.4(14) . .
C4 C3 Pd2 133.3(13) . .
C2 C3 Pd1 78.8(11) . .
C4 C3 Pd1 113.5(13) . .
Pd2 C3 Pd1 92.0(7) . .
C1 C4 C5 121.5(18) . .
C1 C4 C3 107.4(16) . .
C5 C4 C3 131.0(17) . .
C6 C5 C4 117.9(18) . .
C6 C5 H5 121.0 . .
C4 C5 H5 121.0 . .
C5 C6 C7 122.1(19) . .
C5 C6 H6 119.0 . .
C7 C6 H6 119.0 . .
C8 C7 C6 120(2) . .
C8 C7 H7 120.1 . .
C6 C7 H7 120.1 . .
C7 C8 C1 119.5(19) . .
C7 C8 H8 120.2 . .
C1 C8 H8 120.2 . .
C10 C9 C14 118(2) . .
C10 C9 N1 123(2) . .
C14 C9 N1 118(2) . .
C9 C10 C11 121(2) . .
C9 C10 H10 119.4 . .
C11 C10 H10 119.4 . .
C12 C11 C10 121(2) . .
C12 C11 H11 119.4 . .
C10 C11 H11 119.4 . .
C11 C12 C13 119(3) . .
C11 C12 H12 120.6 . .
C13 C12 H12 120.6 . .
C12 C13 C14 119(3) . .
C12 C13 H13 120.4 . .
C14 C13 H13 120.4 . .
C9 C14 C13 120(2) . .
C9 C14 H14 119.8 . .
C13 C14 H14 119.8 . .
O2 C15 O1 127(2) . .
O2 C15 C16 116(2) . .
O1 C15 C16 116.2(19) . .
C17 C16 C18 113(3) . .
C17 C16 C19 111(3) . .
C18 C16 C19 111(3) . .
C17 C16 C15 114(2) . .
C18 C16 C15 107(2) . .
C19 C16 C15 101(2) . .
C17 C16 H16A 54.9 . .
C18 C16 H16A 62.4 . .
C19 C16 H16A 149.2 . .
C15 C16 H16A 109.5 . .
C17 C16 H16B 136.8 . .
C18 C16 H16B 51.2 . .
C19 C16 H16B 59.7 . .
C15 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C17 C16 H16C 56.2 . .
C18 C16 H16C 143.4 . .
C19 C16 H16C 56.6 . .
C15 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
C16 C17 H17A 109.5 . .
C16 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
C16 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
C16 C18 H18A 109.5 . .
C16 C18 H18B 109.5 . .
H18A C18 H18B 109.5 . .
C16 C18 H18C 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
C16 C19 H19A 109.5 . .
C16 C19 H19B 109.5 . .
H19A C19 H19B 109.5 . .
C16 C19 H19C 109.5 . .
H19A C19 H19C 109.5 . .
H19B C19 H19C 109.5 . .
O4 C20 O3 127.1(18) . .
O4 C20 C21 120.3(19) . .
O3 C20 C21 112.5(19) . .
C24 C21 C23 113(4) . .
C24 C21 C22 112(4) . .
C23 C21 C22 112(4) . .
C24 C21 C20 84(3) . .
C23 C21 C20 111(3) . .
C22 C21 C20 121(3) . .
C24 C21 H21A 47.7 . .
C23 C21 H21A 131.3 . .
C22 C21 H21A 64.7 . .
C20 C21 H21A 109.5 . .
C24 C21 H21B 157.1 . .
C23 C21 H21B 80.3 . .
C22 C21 H21B 44.9 . .
C20 C21 H21B 109.5 . .
H21A C21 H21B 109.5 . .
C24 C21 H21C 81.9 . .
C23 C21 H21C 31.0 . .
C22 C21 H21C 128.0 . .
C20 C21 H21C 109.5 . .
H21A C21 H21C 109.5 . .
H21B C21 H21C 109.5 . .
C21 C22 H22A 109.5 . .
C21 C22 H22B 109.5 . .
H22A C22 H22B 109.5 . .
C21 C22 H22C 109.5 . .
H22A C22 H22C 109.5 . .
H22B C22 H22C 109.5 . .
C21 C23 H23A 109.5 . .
C21 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
C21 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
C21 C24 H24A 109.5 . .
C21 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
C21 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
O5 C25 H25A 109.5 . .
O5 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
O5 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
N2 C26 C33 129(2) . .
N2 C26 C29 108.1(19) . .
C33 C26 C29 123(2) . .
N2 C27 C28 115(2) . .
N2 C27 Pd3 118.4(14) . .
C28 C27 Pd3 66.3(12) . .
N2 C27 H27 122.5 . .
C28 C27 H27 122.5 . .
Pd3 C27 H27 86.1 . .
C27 C28 C29 100.4(18) . .
C27 C28 Pd4 125.8(16) . .
C29 C28 Pd4 131.9(16) . .
C27 C28 Pd3 77.4(13) . .
C29 C28 Pd3 111.3(15) . .
Pd4 C28 Pd3 92.9(9) . .
C30 C29 C26 117(2) . .
C30 C29 C28 133(2) . .
C26 C29 C28 109.2(18) . .
C31 C30 C29 121(2) . .
C31 C30 H30 119.7 . .
C29 C30 H30 119.7 . .
C30 C31 C32 120(2) . .
C30 C31 H31 120.0 . .
C32 C31 H31 120.0 . .
C33 C32 C31 122(2) . .
C33 C32 H32 118.9 . .
C31 C32 H32 118.9 . .
C32 C33 C26 117(2) . .
C32 C33 H33 121.6 . .
C26 C33 H33 121.6 . .
C35 C34 C39 118(2) . .
C35 C34 N2 120(2) . .
C39 C34 N2 122(2) . .
C34 C35 C36 120(2) . .
C34 C35 H35 119.8 . .
C36 C35 H35 119.8 . .
C37 C36 C35 119(3) . .
C37 C36 H36 120.4 . .
C35 C36 H36 120.4 . .
C38 C37 C36 120(2) . .
C38 C37 H37 119.8 . .
C36 C37 H37 119.8 . .
C37 C38 C39 119(2) . .
C37 C38 H38 120.5 . .
C39 C38 H38 120.5 . .
C38 C39 C34 123(2) . .
C38 C39 H39 118.6 . .
C34 C39 H39 118.6 . .
O7 C40 O6 127(2) . .
O7 C40 C41 117(2) . .
O6 C40 C41 115(2) . .
C43 C41 C44 113(3) . .
C43 C41 C40 110(3) . .
C44 C41 C40 104(3) . .
C43 C41 C42 114(3) . .
C44 C41 C42 109(3) . .
C40 C41 C42 107(3) . .
C43 C41 H41A 78.4 . .
C44 C41 H41A 35.4 . .
C40 C41 H41A 109.5 . .
C42 C41 H41A 134.1 . .
C43 C41 H41B 33.6 . .
C44 C41 H41B 139.1 . .
C40 C41 H41B 109.5 . .
C42 C41 H41B 82.6 . .
H41A C41 H41B 109.5 . .
C43 C41 H41C 134.2 . .
C44 C41 H41C 79.1 . .
C40 C41 H41C 109.5 . .
C42 C41 H41C 30.3 . .
H41A C41 H41C 109.5 . .
H41B C41 H41C 109.5 . .
C41 C42 H42A 109.5 . .
C41 C42 H42B 109.5 . .
H42A C42 H42B 109.5 . .
C41 C42 H42C 109.5 . .
H42A C42 H42C 109.5 . .
H42B C42 H42C 109.5 . .
C41 C43 H43A 109.5 . .
C41 C43 H43B 109.5 . .
H43A C43 H43B 109.5 . .
C41 C43 H43C 109.5 . .
H43A C43 H43C 109.5 . .
H43B C43 H43C 109.5 . .
C41 C44 H44A 109.5 . .
C41 C44 H44B 109.5 . .
H44A C44 H44B 109.5 . .
C41 C44 H44C 109.5 . .
H44A C44 H44C 109.5 . .
H44B C44 H44C 109.5 . .
O9 C45 O8 129(3) . .
O9 C45 C46 121(3) . .
O8 C45 C46 110(2) . .
C45 C46 C48 117(4) . .
C45 C46 C47 104(4) . .
C48 C46 C47 113(5) . .
C45 C46 C49 100(4) . .
C48 C46 C49 111(5) . .
C47 C46 C49 111(5) . .
C45 C46 H46A 109.5 . .
C48 C46 H46A 62.7 . .
C47 C46 H46A 54.2 . .
C49 C46 H46A 149.3 . .
C45 C46 H46B 109.5 . .
C48 C46 H46B 133.0 . .
C47 C46 H46B 60.6 . .
C49 C46 H46B 50.5 . .
H46A C46 H46B 109.5 . .
C45 C46 H46C 109.5 . .
C48 C46 H46C 47.6 . .
C47 C46 H46C 146.2 . .
C49 C46 H46C 66.6 . .
H46A C46 H46C 109.5 . .
H46B C46 H46C 109.5 . .
C46 C47 H47A 109.5 . .
C46 C47 H47B 109.5 . .
H47A C47 H47B 109.5 . .
C46 C47 H47C 109.5 . .
H47A C47 H47C 109.5 . .
H47B C47 H47C 109.5 . .
C46 C48 H48A 109.5 . .
C46 C48 H48B 109.5 . .
H48A C48 H48B 109.5 . .
C46 C48 H48C 109.5 . .
H48A C48 H48C 109.5 . .
H48B C48 H48C 109.5 . .
C46 C49 H49A 109.5 . .
C46 C49 H49B 109.5 . .
H49A C49 H49B 109.5 . .
C46 C49 H49C 109.5 . .
H49A C49 H49C 109.5 . .
H49B C49 H49C 109.5 . .
O10 C50 H50A 109.5 . .
O10 C50 H50B 109.5 . .
H50A C50 H50B 109.5 . .
O10 C50 H50C 109.5 . .
H50A C50 H50C 109.5 . .
H50B C50 H50C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pd1 O5 1.968(12) .
Pd1 O1 1.989(13) .
Pd1 O3 2.111(12) .
Pd1 C3 2.167(18) .
Pd1 C2 2.351(17) .
Pd1 Pd2 2.9278(17) 2_566
Pd1 Pd2 2.9711(19) .
Pd2 C3 1.960(18) .
Pd2 O5 1.987(11) .
Pd2 O4 1.999(13) 2_566
Pd2 O2 2.080(13) 2_566
Pd2 Pd1 2.9278(17) 2_566
Pd3 O10 1.964(13) .
Pd3 O6 2.000(14) .
Pd3 O8 2.086(16) .
Pd3 C28 2.18(2) .
Pd3 C27 2.32(2) .
Pd3 Pd4 2.910(2) 2_565
Pd3 Pd4 2.974(2) .
Pd4 C28 1.92(2) .
Pd4 O10 1.971(15) .
Pd4 O9 1.993(16) 2_565
Pd4 O7 2.125(15) 2_565
Pd4 Pd3 2.910(2) 2_565
N1 C1 1.35(2) .
N1 C2 1.36(2) .
N1 C9 1.43(2) .
N2 C27 1.34(2) .
N2 C26 1.37(2) .
N2 C34 1.41(3) .
O1 C15 1.27(2) .
O2 C15 1.24(2) .
O2 Pd2 2.080(13) 2_566
O3 C20 1.27(2) .
O4 C20 1.22(2) .
O4 Pd2 1.999(13) 2_566
O5 C25 1.42(2) .
O6 C40 1.28(3) .
O7 C40 1.24(2) .
O7 Pd4 2.125(15) 2_565
O8 C45 1.32(3) .
O9 C45 1.19(3) .
O9 Pd4 1.993(16) 2_565
O10 C50 1.39(2) .
C1 C4 1.39(2) .
C1 C8 1.44(3) .
C2 C3 1.42(2) .
C2 H2 0.9300 .
C3 C4 1.45(2) .
C4 C5 1.40(2) .
C5 C6 1.38(2) .
C5 H5 0.9300 .
C6 C7 1.41(3) .
C6 H6 0.9300 .
C7 C8 1.37(2) .
C7 H7 0.9300 .
C8 H8 0.9300 .
C9 C10 1.28(3) .
C9 C14 1.36(3) .
C10 C11 1.38(3) .
C10 H10 0.9300 .
C11 C12 1.30(3) .
C11 H11 0.9300 .
C12 C13 1.31(3) .
C12 H12 0.9300 .
C13 C14 1.40(3) .
C13 H13 0.9300 .
C14 H14 0.9300 .
C15 C16 1.57(3) .
C16 C17 1.53(4) .
C16 C18 1.53(4) .
C16 C19 1.55(5) .
C16 H16A 0.9600 .
C16 H16B 0.9600 .
C16 H16C 0.9600 .
C17 H17A 0.9600 .
C17 H17B 0.9600 .
C17 H17C 0.9600 .
C18 H18A 0.9600 .
C18 H18B 0.9600 .
C18 H18C 0.9600 .
C19 H19A 0.9600 .
C19 H19B 0.9600 .
C19 H19C 0.9600 .
C20 C21 1.54(3) .
C21 C24 1.52(6) .
C21 C23 1.53(6) .
C21 C22 1.53(7) .
C21 H21A 0.9600 .
C21 H21B 0.9600 .
C21 H21C 0.9600 .
C22 H22A 0.9600 .
C22 H22B 0.9600 .
C22 H22C 0.9600 .
C23 H23A 0.9600 .
C23 H23B 0.9600 .
C23 H23C 0.9600 .
C24 H24A 0.9600 .
C24 H24B 0.9600 .
C24 H24C 0.9600 .
C25 H25A 0.9600 .
C25 H25B 0.9600 .
C25 H25C 0.9600 .
C26 C33 1.41(3) .
C26 C29 1.41(3) .
C27 C28 1.41(2) .
C27 H27 0.9300 .
C28 C29 1.47(3) .
C29 C30 1.39(3) .
C30 C31 1.38(3) .
C30 H30 0.9300 .
C31 C32 1.40(3) .
C31 H31 0.9300 .
C32 C33 1.36(3) .
C32 H32 0.9300 .
C33 H33 0.9300 .
C34 C35 1.36(3) .
C34 C39 1.36(3) .
C35 C36 1.40(3) .
C35 H35 0.9300 .
C36 C37 1.38(3) .
C36 H36 0.9300 .
C37 C38 1.35(3) .
C37 H37 0.9300 .
C38 C39 1.36(3) .
C38 H38 0.9300 .
C39 H39 0.9300 .
C40 C41 1.53(3) .
C41 C43 1.52(4) .
C41 C44 1.53(4) .
C41 C42 1.53(5) .
C41 H41A 0.9600 .
C41 H41B 0.9600 .
C41 H41C 0.9600 .
C42 H42A 0.9600 .
C42 H42B 0.9600 .
C42 H42C 0.9600 .
C43 H43A 0.9600 .
C43 H43B 0.9600 .
C43 H43C 0.9600 .
C44 H44A 0.9600 .
C44 H44B 0.9600 .
C44 H44C 0.9600 .
C45 C46 1.53(3) .
C46 C48 1.53(8) .
C46 C47 1.53(8) .
C46 C49 1.53(8) .
C46 H46A 0.9600 .
C46 H46B 0.9600 .
C46 H46C 0.9600 .
C47 H47A 0.9600 .
C47 H47B 0.9600 .
C47 H47C 0.9600 .
C48 H48A 0.9600 .
C48 H48B 0.9600 .
C48 H48C 0.9600 .
C49 H49A 0.9600 .
C49 H49B 0.9600 .
C49 H49C 0.9600 .
C50 H50A 0.9600 .
C50 H50B 0.9600 .
C50 H50C 0.9600 .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
O5 Pd1 Pd2 C3 147.8(8) . .
O1 Pd1 Pd2 C3 -33.4(8) . .
O3 Pd1 Pd2 C3 178.2(8) . .
C2 Pd1 Pd2 C3 33.5(8) . .
Pd2 Pd1 Pd2 C3 -113.7(7) 2_566 .
O1 Pd1 Pd2 O5 178.9(7) . .
O3 Pd1 Pd2 O5 30.4(7) . .
C3 Pd1 Pd2 O5 -147.8(8) . .
C2 Pd1 Pd2 O5 -114.3(7) . .
Pd2 Pd1 Pd2 O5 98.5(5) 2_566 .
O5 Pd1 Pd2 O4 176.2(7) . 2_566
O1 Pd1 Pd2 O4 -4.9(7) . 2_566
O3 Pd1 Pd2 O4 -153.4(6) . 2_566
C3 Pd1 Pd2 O4 28.4(8) . 2_566
C2 Pd1 Pd2 O4 61.9(7) . 2_566
Pd2 Pd1 Pd2 O4 -85.3(5) 2_566 2_566
O5 Pd1 Pd2 O2 -24.9(6) . 2_566
O1 Pd1 Pd2 O2 153.9(7) . 2_566
O3 Pd1 Pd2 O2 5.5(6) . 2_566
C3 Pd1 Pd2 O2 -172.7(8) . 2_566
C2 Pd1 Pd2 O2 -139.2(7) . 2_566
Pd2 Pd1 Pd2 O2 73.6(4) 2_566 2_566
O5 Pd1 Pd2 Pd1 -98.5(5) . 2_566
O1 Pd1 Pd2 Pd1 80.3(5) . 2_566
O3 Pd1 Pd2 Pd1 -68.1(4) . 2_566
C3 Pd1 Pd2 Pd1 113.7(7) . 2_566
C2 Pd1 Pd2 Pd1 147.2(5) . 2_566
Pd2 Pd1 Pd2 Pd1 0.0 2_566 2_566
O10 Pd3 Pd4 C28 146.7(10) . .
O6 Pd3 Pd4 C28 -32.4(10) . .
O8 Pd3 Pd4 C28 173.7(10) . .
C27 Pd3 Pd4 C28 31.3(10) . .
Pd4 Pd3 Pd4 C28 -115.5(8) 2_565 .
O6 Pd3 Pd4 O10 -179.1(9) . .
O8 Pd3 Pd4 O10 27.0(8) . .
C28 Pd3 Pd4 O10 -146.7(10) . .
C27 Pd3 Pd4 O10 -115.4(8) . .
Pd4 Pd3 Pd4 O10 97.8(6) 2_565 .
O10 Pd3 Pd4 O9 177.8(9) . 2_565
O6 Pd3 Pd4 O9 -1.2(9) . 2_565
O8 Pd3 Pd4 O9 -155.1(8) . 2_565
C28 Pd3 Pd4 O9 31.2(10) . 2_565
C27 Pd3 Pd4 O9 62.5(9) . 2_565
Pd4 Pd3 Pd4 O9 -84.3(7) 2_565 2_565
O10 Pd3 Pd4 O7 -25.7(8) . 2_565
O6 Pd3 Pd4 O7 155.3(8) . 2_565
O8 Pd3 Pd4 O7 1.3(8) . 2_565
C28 Pd3 Pd4 O7 -172.4(10) . 2_565
C27 Pd3 Pd4 O7 -141.0(8) . 2_565
Pd4 Pd3 Pd4 O7 72.2(5) 2_565 2_565
O10 Pd3 Pd4 Pd3 -97.8(6) . 2_565
O6 Pd3 Pd4 Pd3 83.1(6) . 2_565
O8 Pd3 Pd4 Pd3 -70.8(6) . 2_565
C28 Pd3 Pd4 Pd3 115.5(8) . 2_565
C27 Pd3 Pd4 Pd3 146.8(6) . 2_565
Pd4 Pd3 Pd4 Pd3 0.0 2_565 2_565
O5 Pd1 O1 C15 -65(6) . .
O3 Pd1 O1 C15 83.2(14) . .
C3 Pd1 O1 C15 -95.3(15) . .
C2 Pd1 O1 C15 -131.3(15) . .
Pd2 Pd1 O1 C15 5.8(14) 2_566 .
Pd2 Pd1 O1 C15 -73.9(15) . .
O5 Pd1 O3 C20 91.9(15) . .
O1 Pd1 O3 C20 -85.4(15) . .
C3 Pd1 O3 C20 82(5) . .
C2 Pd1 O3 C20 -176.9(15) . .
Pd2 Pd1 O3 C20 1.0(14) 2_566 .
Pd2 Pd1 O3 C20 72.3(15) . .
O1 Pd1 O5 C25 -141(5) . .
O3 Pd1 O5 C25 70.3(13) . .
C3 Pd1 O5 C25 -111.0(13) . .
C2 Pd1 O5 C25 -75.2(13) . .
Pd2 Pd1 O5 C25 147.8(12) 2_566 .
Pd2 Pd1 O5 C25 -132.0(14) . .
O1 Pd1 O5 Pd2 -9(6) . .
O3 Pd1 O5 Pd2 -157.8(5) . .
C3 Pd1 O5 Pd2 21.0(5) . .
C2 Pd1 O5 Pd2 56.8(6) . .
Pd2 Pd1 O5 Pd2 -80.2(4) 2_566 .
C3 Pd2 O5 C25 109.8(13) . .
O4 Pd2 O5 C25 92(7) 2_566 .
O2 Pd2 O5 C25 -66.0(12) 2_566 .
Pd1 Pd2 O5 C25 -140.2(12) 2_566 .
Pd1 Pd2 O5 C25 132.9(13) . .
C3 Pd2 O5 Pd1 -23.0(6) . .
O4 Pd2 O5 Pd1 -41(7) 2_566 .
O2 Pd2 O5 Pd1 161.2(5) 2_566 .
Pd1 Pd2 O5 Pd1 86.9(4) 2_566 .
O10 Pd3 O6 C40 -89(9) . .
O8 Pd3 O6 C40 81.3(18) . .
C28 Pd3 O6 C40 -99.8(18) . .
C27 Pd3 O6 C40 -134.9(18) . .
Pd4 Pd3 O6 C40 4.5(17) 2_565 .
Pd4 Pd3 O6 C40 -79.3(19) . .
O10 Pd3 O8 C45 96.4(18) . .
O6 Pd3 O8 C45 -82.9(18) . .
C28 Pd3 O8 C45 103(4) . .
C27 Pd3 O8 C45 -172.9(17) . .
Pd4 Pd3 O8 C45 3.2(17) 2_565 .
Pd4 Pd3 O8 C45 79.0(18) . .
O6 Pd3 O10 C50 -123(9) . .
O8 Pd3 O10 C50 66.6(15) . .
C28 Pd3 O10 C50 -112.2(16) . .
C27 Pd3 O10 C50 -77.2(16) . .
Pd4 Pd3 O10 C50 143.6(15) 2_565 .
Pd4 Pd3 O10 C50 -133.5(17) . .
O6 Pd3 O10 Pd4 10(9) . .
O8 Pd3 O10 Pd4 -159.9(6) . .
C28 Pd3 O10 Pd4 21.3(7) . .
C27 Pd3 O10 Pd4 56.3(7) . .
Pd4 Pd3 O10 Pd4 -82.9(5) 2_565 .
C28 Pd4 O10 C50 106.8(16) . .
O9 Pd4 O10 C50 107(9) 2_565 .
O7 Pd4 O10 C50 -68.6(16) 2_565 .
Pd3 Pd4 O10 C50 -144.2(15) 2_565 .
Pd3 Pd4 O10 C50 130.6(17) . .
C28 Pd4 O10 Pd3 -23.8(7) . .
O9 Pd4 O10 Pd3 -24(9) 2_565 .
O7 Pd4 O10 Pd3 160.8(6) 2_565 .
Pd3 Pd4 O10 Pd3 85.2(5) 2_565 .
C2 N1 C1 C4 0(2) . .
C9 N1 C1 C4 177.1(19) . .
C2 N1 C1 C8 -176(2) . .
C9 N1 C1 C8 1(3) . .
C1 N1 C2 C3 2(2) . .
C9 N1 C2 C3 -175.6(18) . .
C1 N1 C2 Pd1 73.9(17) . .
C9 N1 C2 Pd1 -104(2) . .
O5 Pd1 C2 N1 -179.0(14) . .
O1 Pd1 C2 N1 -3.7(14) . .
O3 Pd1 C2 N1 87.7(17) . .
C3 Pd1 C2 N1 -104.1(18) . .
Pd2 Pd1 C2 N1 -89.4(14) 2_566 .
Pd2 Pd1 C2 N1 -141.8(15) . .
O5 Pd1 C2 C3 -75.0(11) . .
O1 Pd1 C2 C3 100.4(11) . .
O3 Pd1 C2 C3 -168.3(10) . .
Pd2 Pd1 C2 C3 14.7(15) 2_566 .
Pd2 Pd1 C2 C3 -37.7(10) . .
N1 C2 C3 C4 -2(2) . .
Pd1 C2 C3 C4 -111.9(14) . .
N1 C2 C3 Pd2 -165.1(13) . .
Pd1 C2 C3 Pd2 85.4(12) . .
N1 C2 C3 Pd1 109.4(14) . .
O5 Pd2 C3 C2 -57.5(15) . .
O4 Pd2 C3 C2 121.3(15) 2_566 .
O2 Pd2 C3 C2 -16(7) 2_566 .
Pd1 Pd2 C3 C2 -155.2(13) 2_566 .
Pd1 Pd2 C3 C2 -78.1(14) . .
O5 Pd2 C3 C4 146.2(18) . .
O4 Pd2 C3 C4 -35.1(18) 2_566 .
O2 Pd2 C3 C4 -172(5) 2_566 .
Pd1 Pd2 C3 C4 48.5(19) 2_566 .
Pd1 Pd2 C3 C4 126(2) . .
O5 Pd2 C3 Pd1 20.6(5) . .
O4 Pd2 C3 Pd1 -160.6(6) 2_566 .
O2 Pd2 C3 Pd1 62(6) 2_566 .
Pd1 Pd2 C3 Pd1 -77.1(5) 2_566 .
O5 Pd1 C3 C2 100.6(11) . .
O1 Pd1 C3 C2 -82.0(11) . .
O3 Pd1 C3 C2 110(4) . .
Pd2 Pd1 C3 C2 -169.8(10) 2_566 .
Pd2 Pd1 C3 C2 121.7(14) . .
O5 Pd1 C3 C4 -160.9(13) . .
O1 Pd1 C3 C4 16.5(13) . .
O3 Pd1 C3 C4 -151(4) . .
C2 Pd1 C3 C4 98.5(17) . .
Pd2 Pd1 C3 C4 -71.3(12) 2_566 .
Pd2 Pd1 C3 C4 -139.8(15) . .
O5 Pd1 C3 Pd2 -21.1(5) . .
O1 Pd1 C3 Pd2 156.3(6) . .
O3 Pd1 C3 Pd2 -11(5) . .
C2 Pd1 C3 Pd2 -121.7(14) . .
Pd2 Pd1 C3 Pd2 68.5(6) 2_566 .
N1 C1 C4 C5 -179.4(17) . .
C8 C1 C4 C5 -3(3) . .
N1 C1 C4 C3 -1(2) . .
C8 C1 C4 C3 175.4(17) . .
C2 C3 C4 C1 2(2) . .
Pd2 C3 C4 C1 161.6(15) . .
Pd1 C3 C4 C1 -80.9(16) . .
C2 C3 C4 C5 -180(2) . .
Pd2 C3 C4 C5 -20(3) . .
Pd1 C3 C4 C5 97(2) . .
C1 C4 C5 C6 0(3) . .
C3 C4 C5 C6 -178(2) . .
C4 C5 C6 C7 5(3) . .
C5 C6 C7 C8 -7(3) . .
C6 C7 C8 C1 3(3) . .
N1 C1 C8 C7 177(2) . .
C4 C1 C8 C7 2(3) . .
C1 N1 C9 C10 88(3) . .
C2 N1 C9 C10 -95(3) . .
C1 N1 C9 C14 -85(3) . .
C2 N1 C9 C14 92(3) . .
C14 C9 C10 C11 -3(3) . .
N1 C9 C10 C11 -176(2) . .
C9 C10 C11 C12 -6(4) . .
C10 C11 C12 C13 13(4) . .
C11 C12 C13 C14 -10(4) . .
C10 C9 C14 C13 6(3) . .
N1 C9 C14 C13 179.0(19) . .
C12 C13 C14 C9 1(4) . .
Pd2 O2 C15 O1 -1(3) 2_566 .
Pd2 O2 C15 C16 174.0(14) 2_566 .
Pd1 O1 C15 O2 -5(3) . .
Pd1 O1 C15 C16 179.9(14) . .
O2 C15 C16 C17 169(2) . .
O1 C15 C16 C17 -16(3) . .
O2 C15 C16 C18 43(3) . .
O1 C15 C16 C18 -141(3) . .
O2 C15 C16 C19 -72(3) . .
O1 C15 C16 C19 103(3) . .
Pd2 O4 C20 O3 0(3) 2_566 .
Pd2 O4 C20 C21 -176.5(14) 2_566 .
Pd1 O3 C20 O4 -1(3) . .
Pd1 O3 C20 C21 175.6(12) . .
O4 C20 C21 C24 -70(3) . .
O3 C20 C21 C24 114(3) . .
O4 C20 C21 C23 43(4) . .
O3 C20 C21 C23 -134(3) . .
O4 C20 C21 C22 178(3) . .
O3 C20 C21 C22 1(4) . .
C27 N2 C26 C33 -179(2) . .
C34 N2 C26 C33 -10(4) . .
C27 N2 C26 C29 4(2) . .
C34 N2 C26 C29 173(2) . .
C26 N2 C27 C28 -4(3) . .
C34 N2 C27 C28 -172(2) . .
C26 N2 C27 Pd3 72(2) . .
C34 N2 C27 Pd3 -97(2) . .
O10 Pd3 C27 N2 -177.5(17) . .
O6 Pd3 C27 N2 -0.3(17) . .
O8 Pd3 C27 N2 90.1(19) . .
C28 Pd3 C27 N2 -107(2) . .
Pd4 Pd3 C27 N2 -84.2(18) 2_565 .
Pd4 Pd3 C27 N2 -141.1(18) . .
O10 Pd3 C27 C28 -70.9(13) . .
O6 Pd3 C27 C28 106.4(13) . .
O8 Pd3 C27 C28 -163.2(12) . .
Pd4 Pd3 C27 C28 22.5(16) 2_565 .
Pd4 Pd3 C27 C28 -34.5(11) . .
N2 C27 C28 C29 2(2) . .
Pd3 C27 C28 C29 -109.7(15) . .
N2 C27 C28 Pd4 -163.9(16) . .
Pd3 C27 C28 Pd4 84.5(16) . .
N2 C27 C28 Pd3 111.7(17) . .
O10 Pd4 C28 C27 -55.4(19) . .
O9 Pd4 C28 C27 125(2) 2_565 .
O7 Pd4 C28 C27 -8(9) 2_565 .
Pd3 Pd4 C28 C27 -149.9(17) 2_565 .
Pd3 Pd4 C28 C27 -76.6(19) . .
O10 Pd4 C28 C29 143(2) . .
O9 Pd4 C28 C29 -37(2) 2_565 .
O7 Pd4 C28 C29 -169(6) 2_565 .
Pd3 Pd4 C28 C29 49(2) 2_565 .
Pd3 Pd4 C28 C29 122(2) . .
O10 Pd4 C28 Pd3 21.2(6) . .
O9 Pd4 C28 Pd3 -158.8(7) 2_565 .
O7 Pd4 C28 Pd3 68(7) 2_565 .
Pd3 Pd4 C28 Pd3 -73.3(7) 2_565 .
O10 Pd3 C28 C27 104.4(13) . .
O6 Pd3 C28 C27 -76.4(13) . .
O8 Pd3 C28 C27 97(4) . .
Pd4 Pd3 C28 C27 -165.0(11) 2_565 .
Pd4 Pd3 C28 C27 126.1(15) . .
O10 Pd3 C28 C29 -159.2(15) . .
O6 Pd3 C28 C29 20.0(15) . .
O8 Pd3 C28 C29 -166(3) . .
C27 Pd3 C28 C29 96.4(19) . .
Pd4 Pd3 C28 C29 -68.6(14) 2_565 .
Pd4 Pd3 C28 C29 -137.5(18) . .
O10 Pd3 C28 Pd4 -21.7(7) . .
O6 Pd3 C28 Pd4 157.6(7) . .
O8 Pd3 C28 Pd4 -29(4) . .
C27 Pd3 C28 Pd4 -126.1(15) . .
Pd4 Pd3 C28 Pd4 68.9(7) 2_565 .
N2 C26 C29 C30 -180(2) . .
C33 C26 C29 C30 3(3) . .
N2 C26 C29 C28 -3(3) . .
C33 C26 C29 C28 180(2) . .
C27 C28 C29 C30 177(2) . .
Pd4 C28 C29 C30 -19(4) . .
Pd3 C28 C29 C30 96(3) . .
C27 C28 C29 C26 1(2) . .
Pd4 C28 C29 C26 165.1(17) . .
Pd3 C28 C29 C26 -79.9(19) . .
C26 C29 C30 C31 -2(3) . .
C28 C29 C30 C31 -178(2) . .
C29 C30 C31 C32 1(4) . .
C30 C31 C32 C33 1(4) . .
C31 C32 C33 C26 0(4) . .
N2 C26 C33 C32 -178(2) . .
C29 C26 C33 C32 -1(4) . .
C27 N2 C34 C35 68(3) . .
C26 N2 C34 C35 -98(3) . .
C27 N2 C34 C39 -113(3) . .
C26 N2 C34 C39 80(3) . .
C39 C34 C35 C36 3(4) . .
N2 C34 C35 C36 -178(2) . .
C34 C35 C36 C37 -2(4) . .
C35 C36 C37 C38 1(4) . .
C36 C37 C38 C39 -2(4) . .
C37 C38 C39 C34 3(4) . .
C35 C34 C39 C38 -3(4) . .
N2 C34 C39 C38 178(2) . .
Pd4 O7 C40 O6 -4(4) 2_565 .
Pd4 O7 C40 C41 171.8(18) 2_565 .
Pd3 O6 C40 O7 -2(4) . .
Pd3 O6 C40 C41 -178.2(18) . .
O7 C40 C41 C43 45(4) . .
O6 C40 C41 C43 -139(3) . .
O7 C40 C41 C44 166(3) . .
O6 C40 C41 C44 -18(4) . .
O7 C40 C41 C42 -79(3) . .
O6 C40 C41 C42 97(3) . .
Pd4 O9 C45 O8 -3(4) 2_565 .
Pd4 O9 C45 C46 -178.5(17) 2_565 .
Pd3 O8 C45 O9 -2(4) . .
Pd3 O8 C45 C46 174.5(15) . .
O9 C45 C46 C48 -4(5) . .
O8 C45 C46 C48 -180(4) . .
O9 C45 C46 C47 -129(4) . .
O8 C45 C46 C47 55(4) . .
O9 C45 C46 C49 116(4) . .
O8 C45 C46 C49 -60(4) . .
