#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:20:41 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179105 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/67/4306746.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_4306746
loop_
_publ_author_name
'Alen Hadzovic'
'Datong Song'
_publ_section_title
;
Syntheses, Structures, and Reactivities of Novel Palladium
β-Diiminato-Acetate Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              12010
_journal_page_last               12017
_journal_paper_doi               10.1021/ic801557c
_journal_volume                  47
_journal_year                    2008
_chemical_formula_moiety         'C42 H46 N4 O8 Pd2 Zn, C4 H8 O'
_chemical_formula_sum            'C46 H54 N4 O9 Pd2 Zn'
_chemical_formula_weight         1085.16
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           60
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_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                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   28.9299(8)
_cell_length_b                   17.8215(5)
_cell_length_c                   17.8255(5)
_cell_measurement_reflns_used    7951
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      25.00
_cell_measurement_theta_min      2.92
_cell_volume                     9190.4(4)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.982
_diffrn_measured_fraction_theta_max 0.982
_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  0.1105
_diffrn_reflns_av_sigmaI/netI    0.0709
_diffrn_reflns_limit_h_max       34
_diffrn_reflns_limit_h_min       -34
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            43705
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         2.92
_exptl_absorpt_coefficient_mu    1.350
_exptl_absorpt_correction_T_max  0.898
_exptl_absorpt_correction_T_min  0.572
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
multi-scan from symetry-related measurements
Sortav (blessing 1995)
;
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.568
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             4416
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.08
_refine_diff_density_max         1.357
_refine_diff_density_min         -0.845
_refine_diff_density_rms         0.119
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     567
_refine_ls_number_reflns         7951
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.038
_refine_ls_R_factor_all          0.0911
_refine_ls_R_factor_gt           0.0511
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0659P)²+9.2620P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1152
_refine_ls_wR_factor_ref         0.1396
_reflns_number_gt                5291
_reflns_number_total             7951
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic801557c_si_001_6.cif
_cod_data_source_block           Complex_5
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4306746
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y+1/2, z+1/2'
'-x, y, -z+1/2'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x-1/2, y-1/2, -z-1/2'
'x, -y, z-1/2'
'-x-1/2, 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 0.323195(15) 0.48244(3) 0.01459(2) 0.03453(15) Uani 1 1 d . . .
Pd2 Pd 0.365997(15) 0.79354(3) 0.01389(2) 0.03403(15) Uani 1 1 d . . .
Zn1 Zn 0.37982(2) 0.63155(4) -0.03675(4) 0.0404(2) Uani 1 1 d . . .
O1 O 0.41889(13) 0.8111(2) -0.0598(2) 0.0400(10) Uani 1 1 d . . .
O1S O 0.4574(2) 0.9281(5) 0.4072(5) 0.134(3) Uani 1 1 d . . .
O2 O 0.41766(14) 0.6936(2) -0.1055(2) 0.0431(10) Uani 1 1 d . . .
O3 O 0.36406(14) 0.4405(2) -0.0703(2) 0.0378(10) Uani 1 1 d . . .
O4 O 0.41029(14) 0.5413(2) -0.0773(2) 0.0456(11) Uani 1 1 d . . .
O5 O 0.40419(15) 0.6335(2) 0.0647(2) 0.0446(11) Uani 1 1 d . . .
O6 O 0.41586(13) 0.7567(3) 0.08710(19) 0.0398(10) Uani 1 1 d . . .
O7 O 0.28307(13) 0.5266(2) -0.0692(2) 0.0381(10) Uani 1 1 d . . .
O8 O 0.31754(14) 0.6401(2) -0.0754(2) 0.0438(10) Uani 1 1 d . . .
N1 N 0.27795(16) 0.5172(3) 0.0917(3) 0.0390(12) Uani 1 1 d . . .
N2 N 0.36384(16) 0.4345(3) 0.0914(3) 0.0389(12) Uani 1 1 d . . .
N3 N 0.31850(16) 0.7873(3) 0.0950(2) 0.0349(12) Uani 1 1 d . . .
N4 N 0.32008(16) 0.8277(3) -0.0623(2) 0.0347(11) Uani 1 1 d . . .
C1 C 0.2459(2) 0.5396(4) 0.2165(3) 0.0529(18) Uani 1 1 d . . .
H1A H 0.2377 0.5912 0.2027 0.079 Uiso 1 1 calc R . .
H1B H 0.2561 0.5384 0.2689 0.079 Uiso 1 1 calc R . .
H1C H 0.2188 0.5072 0.2104 0.079 Uiso 1 1 calc R . .
C1S C 0.4697(4) 0.9999(7) 0.3899(7) 0.114(4) Uani 1 1 d . . .
H1SA H 0.4599 1.0342 0.4306 0.137 Uiso 1 1 calc R . .
H1SB H 0.4541 1.0157 0.3431 0.137 Uiso 1 1 calc R . .
C2 C 0.2847(2) 0.5119(4) 0.1660(3) 0.0438(16) Uani 1 1 d . . .
C2S C 0.5200(4) 1.0044(7) 0.3801(8) 0.126(4) Uani 1 1 d . . .
H2SA H 0.5349 1.0264 0.4250 0.151 Uiso 1 1 calc R . .
H2SB H 0.5281 1.0349 0.3356 0.151 Uiso 1 1 calc R . .
C3 C 0.3235(2) 0.4810(4) 0.1993(3) 0.0438(16) Uani 1 1 d . . .
H3A H 0.3255 0.4864 0.2522 0.053 Uiso 1 1 calc R . .
C3S C 0.5338(4) 0.9252(6) 0.3698(8) 0.125(4) Uani 1 1 d . . .
H3SA H 0.5415 0.9154 0.3166 0.150 Uiso 1 1 calc R . .
H3SB H 0.5613 0.9135 0.4008 0.150 Uiso 1 1 calc R . .
C4 C 0.3600(2) 0.4431(3) 0.1655(3) 0.0396(15) Uani 1 1 d . . .
C4S C 0.4948(4) 0.8799(6) 0.3929(8) 0.133(5) Uani 1 1 d . . .
H4SA H 0.4866 0.8438 0.3528 0.160 Uiso 1 1 calc R . .
H4SB H 0.5027 0.8512 0.4387 0.160 Uiso 1 1 calc R . .
C5 C 0.3958(2) 0.4078(4) 0.2161(3) 0.0523(18) Uani 1 1 d . . .
H5A H 0.3984 0.3542 0.2046 0.078 Uiso 1 1 calc R . .
H5B H 0.3865 0.4141 0.2686 0.078 Uiso 1 1 calc R . .
H5C H 0.4258 0.4321 0.2079 0.078 Uiso 1 1 calc R . .
C6 C 0.2329(2) 0.5414(4) 0.0653(3) 0.0378(15) Uani 1 1 d . . .
C7 C 0.1973(2) 0.4898(4) 0.0581(3) 0.0446(16) Uani 1 1 d . . .
H7A H 0.2023 0.4386 0.0706 0.054 Uiso 1 1 calc R . .
C8 C 0.1544(2) 0.5132(4) 0.0326(3) 0.0506(18) Uani 1 1 d . . .
H8A H 0.1296 0.4783 0.0296 0.061 Uiso 1 1 calc R . .
C9 C 0.1475(2) 0.5868(4) 0.0115(3) 0.0499(17) Uani 1 1 d . . .
H9A H 0.1183 0.6025 -0.0073 0.060 Uiso 1 1 calc R . .
C10 C 0.1828(2) 0.6365(4) 0.0180(3) 0.0529(18) Uani 1 1 d . . .
H10A H 0.1779 0.6872 0.0036 0.064 Uiso 1 1 calc R . .
C11 C 0.2261(2) 0.6156(4) 0.0451(3) 0.0455(16) Uani 1 1 d . . .
H11A H 0.2504 0.6513 0.0496 0.055 Uiso 1 1 calc R . .
C12 C 0.4023(2) 0.3919(3) 0.0638(3) 0.0395(15) Uani 1 1 d . . .
C13 C 0.4455(2) 0.4241(4) 0.0553(3) 0.0429(15) Uani 1 1 d . . .
H13A H 0.4499 0.4756 0.0671 0.051 Uiso 1 1 calc R . .
C14 C 0.4825(2) 0.3819(4) 0.0299(3) 0.0477(17) Uani 1 1 d . . .
H14A H 0.5122 0.4039 0.0255 0.057 Uiso 1 1 calc R . .
C15 C 0.4759(2) 0.3082(4) 0.0112(3) 0.0492(17) Uani 1 1 d . . .
H15A H 0.5013 0.2797 -0.0070 0.059 Uiso 1 1 calc R . .
C16 C 0.4331(2) 0.2746(4) 0.0182(3) 0.0452(16) Uani 1 1 d . . .
H16A H 0.4291 0.2232 0.0055 0.054 Uiso 1 1 calc R . .
C17 C 0.3958(2) 0.3169(4) 0.0444(3) 0.0436(15) Uani 1 1 d . . .
H17A H 0.3661 0.2946 0.0489 0.052 Uiso 1 1 calc R . .
C18 C 0.2409(2) 0.7932(4) 0.1522(3) 0.0469(16) Uani 1 1 d . . .
H18A H 0.2523 0.8263 0.1921 0.070 Uiso 1 1 calc R . .
H18B H 0.2395 0.7415 0.1709 0.070 Uiso 1 1 calc R . .
H18C H 0.2100 0.8094 0.1366 0.070 Uiso 1 1 calc R . .
C19 C 0.2733(2) 0.7968(3) 0.0860(3) 0.0388(15) Uani 1 1 d . . .
C20 C 0.2534(2) 0.8121(3) 0.0171(3) 0.0381(14) Uani 1 1 d . . .
H20A H 0.2206 0.8115 0.0163 0.046 Uiso 1 1 calc R . .
C21 C 0.2746(2) 0.8284(3) -0.0517(3) 0.0368(14) Uani 1 1 d . . .
C22 C 0.2432(2) 0.8507(4) -0.1149(3) 0.0474(17) Uani 1 1 d . . .
H22A H 0.2501 0.8200 -0.1592 0.071 Uiso 1 1 calc R . .
H22B H 0.2480 0.9038 -0.1270 0.071 Uiso 1 1 calc R . .
H22C H 0.2109 0.8428 -0.0999 0.071 Uiso 1 1 calc R . .
C23 C 0.3353(2) 0.7745(4) 0.1698(3) 0.0404(15) Uani 1 1 d . . .
C24 C 0.3331(2) 0.7035(4) 0.2011(3) 0.0411(15) Uani 1 1 d . . .
H24A H 0.3210 0.6628 0.1728 0.049 Uiso 1 1 calc R . .
C25 C 0.3486(2) 0.6918(4) 0.2746(4) 0.0518(18) Uani 1 1 d . . .
H25A H 0.3470 0.6432 0.2963 0.062 Uiso 1 1 calc R . .
C26 C 0.3660(2) 0.7507(5) 0.3151(4) 0.0558(19) Uani 1 1 d . . .
H26A H 0.3759 0.7429 0.3654 0.067 Uiso 1 1 calc R . .
C27 C 0.3694(2) 0.8211(4) 0.2839(4) 0.057(2) Uani 1 1 d . . .
H27A H 0.3826 0.8612 0.3117 0.069 Uiso 1 1 calc R . .
C28 C 0.3533(2) 0.8334(4) 0.2109(3) 0.0477(16) Uani 1 1 d . . .
H28A H 0.3548 0.8822 0.1896 0.057 Uiso 1 1 calc R . .
C29 C 0.33756(19) 0.8488(4) -0.1355(3) 0.0388(15) Uani 1 1 d . . .
C30 C 0.3405(2) 0.7935(4) -0.1917(3) 0.0443(16) Uani 1 1 d . . .
H30A H 0.3313 0.7433 -0.1819 0.053 Uiso 1 1 calc R . .
C31 C 0.3573(2) 0.8142(4) -0.2621(3) 0.0494(17) Uani 1 1 d . . .
H31A H 0.3591 0.7776 -0.3007 0.059 Uiso 1 1 calc R . .
C32 C 0.3711(2) 0.8853(5) -0.2764(3) 0.0534(19) Uani 1 1 d . . .
H32A H 0.3827 0.8983 -0.3246 0.064 Uiso 1 1 calc R . .
C33 C 0.3684(2) 0.9390(4) -0.2204(4) 0.0543(18) Uani 1 1 d . . .
H33A H 0.3780 0.9890 -0.2302 0.065 Uiso 1 1 calc R . .
C34 C 0.3515(2) 0.9198(4) -0.1499(3) 0.0471(16) Uani 1 1 d . . .
H34A H 0.3497 0.9568 -0.1117 0.057 Uiso 1 1 calc R . .
C35 C 0.2495(2) 0.6195(4) -0.1466(3) 0.0495(17) Uani 1 1 d . . .
H35A H 0.2214 0.5894 -0.1395 0.074 Uiso 1 1 calc R . .
H35B H 0.2606 0.6135 -0.1982 0.074 Uiso 1 1 calc R . .
H35C H 0.2425 0.6724 -0.1371 0.074 Uiso 1 1 calc R . .
C36 C 0.2864(2) 0.5932(4) -0.0924(3) 0.0378(14) Uani 1 1 d . . .
C37 C 0.4305(2) 0.4348(4) -0.1480(3) 0.0463(16) Uani 1 1 d . . .
H37A H 0.4618 0.4551 -0.1437 0.069 Uiso 1 1 calc R . .
H37B H 0.4192 0.4420 -0.1994 0.069 Uiso 1 1 calc R . .
H37C H 0.4308 0.3812 -0.1361 0.069 Uiso 1 1 calc R . .
C38 C 0.3992(2) 0.4749(4) -0.0946(3) 0.0389(15) Uani 1 1 d . . .
C39 C 0.4543(2) 0.6697(4) 0.1646(3) 0.0473(17) Uani 1 1 d . . .
H39A H 0.4438 0.6955 0.2100 0.071 Uiso 1 1 calc R . .
H39B H 0.4856 0.6863 0.1520 0.071 Uiso 1 1 calc R . .
H39C H 0.4543 0.6154 0.1733 0.071 Uiso 1 1 calc R . .
C40 C 0.4219(2) 0.6880(4) 0.1002(3) 0.0379(15) Uani 1 1 d . . .
C41 C 0.4685(2) 0.7816(4) -0.1614(4) 0.0508(17) Uani 1 1 d . . .
H41A H 0.4879 0.7380 -0.1729 0.076 Uiso 1 1 calc R . .
H41B H 0.4878 0.8219 -0.1407 0.076 Uiso 1 1 calc R . .
H41C H 0.4535 0.7992 -0.2075 0.076 Uiso 1 1 calc R . .
C42 C 0.4318(2) 0.7596(4) -0.1043(3) 0.0412(15) Uani 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pd Pd -0.9988 1.0072 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N1 Pd1 N2 92.7(2) . . ?
N1 Pd1 O7 90.62(18) . . ?
N2 Pd1 O7 176.26(18) . . ?
N1 Pd1 O3 173.84(18) . . ?
N2 Pd1 O3 90.63(17) . . ?
O7 Pd1 O3 85.92(15) . . ?
N4 Pd2 N3 93.00(19) . . ?
N4 Pd2 O1 90.81(17) . . ?
N3 Pd2 O1 171.93(18) . . ?
N4 Pd2 O6 176.54(17) . . ?
N3 Pd2 O6 90.29(17) . . ?
O1 Pd2 O6 86.06(15) . . ?
N4 Pd2 Zn1 100.03(14) . . ?
N3 Pd2 Zn1 104.56(14) . . ?
O1 Pd2 Zn1 81.74(12) . . ?
O6 Pd2 Zn1 78.08(12) . . ?
O8 Zn1 O5 131.93(17) . . ?
O8 Zn1 O4 110.51(18) . . ?
O5 Zn1 O4 101.15(17) . . ?
O8 Zn1 O2 104.53(16) . . ?
O5 Zn1 O2 111.44(17) . . ?
O4 Zn1 O2 88.94(17) . . ?
O8 Zn1 Pd2 84.75(13) . . ?
O5 Zn1 Pd2 75.84(12) . . ?
O4 Zn1 Pd2 159.90(13) . . ?
O2 Zn1 Pd2 74.17(12) . . ?
C42 O1 Pd2 120.8(4) . . ?
C1S O1S C4S 109.4(8) . . ?
C42 O2 Zn1 134.3(4) . . ?
C38 O3 Pd1 122.5(4) . . ?
C38 O4 Zn1 137.7(4) . . ?
C40 O5 Zn1 128.7(4) . . ?
C40 O6 Pd2 121.8(4) . . ?
C36 O7 Pd1 123.9(4) . . ?
C36 O8 Zn1 134.1(4) . . ?
C2 N1 C6 118.1(5) . . ?
C2 N1 Pd1 124.2(4) . . ?
C6 N1 Pd1 117.3(3) . . ?
C4 N2 C12 117.7(5) . . ?
C4 N2 Pd1 125.5(4) . . ?
C12 N2 Pd1 116.6(3) . . ?
C19 N3 C23 117.7(5) . . ?
C19 N3 Pd2 125.6(4) . . ?
C23 N3 Pd2 116.6(4) . . ?
C21 N4 C29 118.2(5) . . ?
C21 N4 Pd2 124.3(4) . . ?
C29 N4 Pd2 117.4(4) . . ?
O1S C1S C2S 109.7(9) . . ?
N1 C2 C3 124.7(6) . . ?
N1 C2 C1 117.0(5) . . ?
C3 C2 C1 118.3(5) . . ?
C1S C2S C3S 103.5(10) . . ?
C2 C3 C4 128.6(6) . . ?
C4S C3S C2S 106.5(9) . . ?
N2 C4 C3 123.2(5) . . ?
N2 C4 C5 119.1(5) . . ?
C3 C4 C5 117.6(5) . . ?
O1S C4S C3S 108.1(9) . . ?
C11 C6 C7 120.2(6) . . ?
C11 C6 N1 119.6(6) . . ?
C7 C6 N1 120.1(6) . . ?
C8 C7 C6 119.8(6) . . ?
C9 C8 C7 120.3(7) . . ?
C10 C9 C8 119.2(6) . . ?
C9 C10 C11 122.1(7) . . ?
C6 C11 C10 118.2(6) . . ?
C13 C12 C17 119.5(6) . . ?
C13 C12 N2 121.3(6) . . ?
C17 C12 N2 119.3(6) . . ?
C12 C13 C14 120.5(6) . . ?
C15 C14 C13 119.7(6) . . ?
C14 C15 C16 121.2(6) . . ?
C15 C16 C17 119.2(6) . . ?
C12 C17 C16 119.8(6) . . ?
N3 C19 C20 122.9(5) . . ?
N3 C19 C18 120.8(5) . . ?
C20 C19 C18 116.3(6) . . ?
C19 C20 C21 129.4(6) . . ?
N4 C21 C20 123.8(5) . . ?
N4 C21 C22 119.6(5) . . ?
C20 C21 C22 116.5(5) . . ?
C28 C23 C24 119.9(6) . . ?
C28 C23 N3 119.9(6) . . ?
C24 C23 N3 120.2(6) . . ?
C23 C24 C25 119.9(6) . . ?
C26 C25 C24 119.8(7) . . ?
C25 C26 C27 120.8(6) . . ?
C26 C27 C28 119.7(7) . . ?
C23 C28 C27 120.0(7) . . ?
C34 C29 C30 120.1(6) . . ?
C34 C29 N4 121.3(5) . . ?
C30 C29 N4 118.6(6) . . ?
C31 C30 C29 118.4(6) . . ?
C32 C31 C30 121.3(6) . . ?
C31 C32 C33 119.6(6) . . ?
C32 C33 C34 120.1(7) . . ?
C29 C34 C33 120.5(6) . . ?
O7 C36 O8 126.6(6) . . ?
O7 C36 C35 116.5(6) . . ?
O8 C36 C35 116.8(6) . . ?
O3 C38 O4 125.0(5) . . ?
O3 C38 C37 118.3(6) . . ?
O4 C38 C37 116.7(6) . . ?
O6 C40 O5 126.7(6) . . ?
O6 C40 C39 115.8(6) . . ?
O5 C40 C39 117.5(6) . . ?
O2 C42 O1 126.6(6) . . ?
O2 C42 C41 117.5(6) . . ?
O1 C42 C41 115.9(6) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pd1 N1 1.996(4) . ?
Pd1 N2 1.997(5) . ?
Pd1 O7 2.049(4) . ?
Pd1 O3 2.060(4) . ?
Pd2 N4 1.995(4) . ?
Pd2 N3 1.998(4) . ?
Pd2 O1 2.041(4) . ?
Pd2 O6 2.053(4) . ?
Pd2 Zn1 3.0511(9) . ?
Zn1 O8 1.935(4) . ?
Zn1 O5 1.941(4) . ?
Zn1 O4 1.971(4) . ?
Zn1 O2 1.980(4) . ?
O1 C42 1.270(7) . ?
O1S C1S 1.364(12) . ?
O1S C4S 1.405(11) . ?
O2 C42 1.246(7) . ?
O3 C38 1.264(7) . ?
O4 C38 1.264(7) . ?
O5 C40 1.268(7) . ?
O6 C40 1.259(7) . ?
O7 C36 1.261(7) . ?
O8 C36 1.266(7) . ?
N1 C2 1.343(7) . ?
N1 C6 1.451(7) . ?
N2 C4 1.334(7) . ?
N2 C12 1.434(7) . ?
N3 C19 1.327(7) . ?
N3 C23 1.438(7) . ?
N4 C21 1.329(7) . ?
N4 C29 1.448(7) . ?
C1 C2 1.521(8) . ?
C1S C2S 1.466(14) . ?
C2 C3 1.385(8) . ?
C2S C3S 1.479(13) . ?
C3 C4 1.391(8) . ?
C3S C4S 1.448(13) . ?
C4 C5 1.511(8) . ?
C6 C11 1.385(8) . ?
C6 C7 1.387(8) . ?
C7 C8 1.386(9) . ?
C8 C9 1.379(10) . ?
C9 C10 1.358(10) . ?
C10 C11 1.393(9) . ?
C12 C13 1.384(8) . ?
C12 C17 1.394(8) . ?
C13 C14 1.384(9) . ?
C14 C15 1.367(9) . ?
C15 C16 1.382(9) . ?
C16 C17 1.396(8) . ?
C18 C19 1.508(8) . ?
C19 C20 1.384(8) . ?
C20 C21 1.401(8) . ?
C21 C22 1.503(8) . ?
C23 C28 1.382(9) . ?
C23 C24 1.384(8) . ?
C24 C25 1.401(8) . ?
C25 C26 1.371(10) . ?
C26 C27 1.376(10) . ?
C27 C28 1.398(9) . ?
C29 C34 1.352(8) . ?
C29 C30 1.409(8) . ?
C30 C31 1.395(8) . ?
C31 C32 1.353(9) . ?
C32 C33 1.385(10) . ?
C33 C34 1.391(8) . ?
C35 C36 1.513(8) . ?
C37 C38 1.495(8) . ?
C39 C40 1.517(8) . ?
C41 C42 1.523(8) . ?
