#------------------------------------------------------------------------------
#$Date: 2016-03-25 09:36:42 +0100 (vie 25 de mar de 2016) $
#$Revision: 179756 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/52/7005295.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_7005295
loop_
_publ_author_name
'Bröring, Martin'
'Kleeberg, Christian'
_publ_section_title
;
 Cyclometalation vs. Werner-type coordination of sterically enforced
 palladium(II)-1,3-bis(pyridyl-2-imino)isoindolines (Pd-BPIs).
;
_journal_issue                   11
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1101
_journal_page_last               1103
_journal_paper_doi               10.1039/b700400a
_journal_year                    2007
_chemical_formula_moiety         'C48 H44 Cl2 N10 O4 Pd4'
_chemical_formula_sum            'C48 H44 Cl2 N10 O4 Pd4'
_chemical_formula_weight         1321.44
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     heavy
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.44(3)
_cell_angle_beta                 97.63(2)
_cell_angle_gamma                104.77(2)
_cell_formula_units_Z            1
_cell_length_a                   8.5886(16)
_cell_length_b                   11.834(3)
_cell_length_c                   12.123(3)
_cell_measurement_reflns_used    4557
_cell_measurement_temperature    193(2)
_cell_measurement_theta_max      26.05
_cell_measurement_theta_min      1.65
_cell_volume                     1179.8(5)
_computing_cell_refinement       'Stoe Cell'
_computing_data_collection       'Stoe Expose'
_computing_data_reduction        'Stoe Integrate'
_computing_publication_material  'WinGX v1.64.05'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      193(2)
_diffrn_measured_fraction_theta_full 0.940
_diffrn_measured_fraction_theta_max 0.916
_diffrn_measurement_device_type  'IPDS1 (Stoe)'
_diffrn_measurement_method       phi-scans
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1183
_diffrn_reflns_av_sigmaI/netI    0.1538
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            11593
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         26.07
_diffrn_reflns_theta_min         2.41
_exptl_absorpt_coefficient_mu    1.670
_exptl_absorpt_correction_T_max  0.9285
_exptl_absorpt_correction_T_min  0.6901
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
[c.f. r.h. blessing, acta cryst. (1995), a51, 33-38]
;
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.860
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             652
_exptl_crystal_recrystallization_method 'evap. of a sol. in CH2Cl2/n-Hexane '
_exptl_crystal_size_max          0.246
_exptl_crystal_size_mid          0.116
_exptl_crystal_size_min          0.022
_refine_diff_density_max         1.476
_refine_diff_density_min         -2.103
_refine_diff_density_rms         0.199
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.829
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     313
_refine_ls_number_reflns         4296
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.829
_refine_ls_R_factor_all          0.1626
_refine_ls_R_factor_gt           0.0869
_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)+(0.1406P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2055
_refine_ls_wR_factor_ref         0.2451
_reflns_number_gt                1747
_reflns_number_total             4296
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b700400a.txt
_cod_data_source_block           ck10ck
_cod_original_cell_volume        1179.9(5)
_cod_database_code               7005295
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
C1 C 0.1815(19) 0.3401(16) 0.1521(17) 0.092(6) Uani 1 1 d . . .
H1A H 0.1859 0.2758 0.1023 0.138 Uiso 1 1 calc R . .
H1B H 0.1311 0.3948 0.1096 0.138 Uiso 1 1 calc R . .
H1C H 0.1169 0.3088 0.2111 0.138 Uiso 1 1 calc R . .
C2 C 0.3565(19) 0.4051(16) 0.205(2) 0.094(7) Uani 1 1 d . . .
C3 C 0.417(2) 0.5135(16) 0.1493(19) 0.093(6) Uani 1 1 d . . .
H3 H 0.3557 0.5343 0.0851 0.112 Uiso 1 1 calc R . .
C4 C 0.568(2) 0.5851(17) 0.194(2) 0.093(6) Uani 1 1 d . . .
C5 C 0.640(2) 0.6962(16) 0.140(2) 0.109(7) Uani 1 1 d . . .
H5A H 0.6321 0.6806 0.0599 0.163 Uiso 1 1 calc R . .
H5B H 0.7544 0.7263 0.1719 0.163 Uiso 1 1 calc R . .
H5C H 0.5803 0.7543 0.1534 0.163 Uiso 1 1 calc R . .
C6 C 0.641(2) 0.5515(17) 0.293(2) 0.099(6) Uani 1 1 d . . .
H6 H 0.7406 0.6012 0.3279 0.119 Uiso 1 1 calc R . .
C7 C 0.575(2) 0.4482(12) 0.343(2) 0.090(7) Uani 1 1 d . . .
C8 C 0.6156(17) 0.3479(14) 0.5094(16) 0.071(4) Uani 1 1 d . . .
C9 C 0.7137(17) 0.3432(13) 0.6120(16) 0.073(5) Uani 1 1 d . . .
C10 C 0.8550(18) 0.4189(16) 0.6658(18) 0.082(5) Uani 1 1 d . . .
H10 H 0.9031 0.4888 0.6315 0.099 Uiso 1 1 calc R . .
C11 C 0.924(2) 0.3952(16) 0.764(2) 0.090(6) Uani 1 1 d . . .
H11 H 1.0240 0.4458 0.7965 0.108 Uiso 1 1 calc R . .
C12 C 0.851(2) 0.2964(18) 0.821(2) 0.101(6) Uani 1 1 d . . .
H12 H 0.8957 0.2827 0.8940 0.122 Uiso 1 1 calc R . .
C13 C 0.7077(18) 0.2182(15) 0.765(2) 0.083(6) Uani 1 1 d . . .
H13 H 0.6571 0.1494 0.7995 0.100 Uiso 1 1 calc R . .
C14 C 0.6453(18) 0.2407(16) 0.6654(16) 0.071(4) Uani 1 1 d . . .
C15 C 0.5030(15) 0.1790(15) 0.5817(15) 0.070(5) Uani 1 1 d . . .
C17 C 0.2408(16) 0.0430(12) 0.4116(17) 0.069(5) Uani 1 1 d . . .
C18 C 0.0902(17) -0.0283(13) 0.3523(15) 0.068(4) Uani 1 1 d . . .
C19 C -0.0020(17) -0.0034(15) 0.2440(16) 0.079(5) Uani 1 1 d . . .
H19A H 0.0383 0.0790 0.2277 0.118 Uiso 1 1 calc R . .
H19B H -0.1181 -0.0203 0.2506 0.118 Uiso 1 1 calc R . .
H19C H 0.0141 -0.0530 0.1836 0.118 Uiso 1 1 calc R . .
C20 C 0.0176(17) -0.1305(14) 0.4044(16) 0.073(5) Uani 1 1 d . . .
H20 H -0.0813 -0.1800 0.3679 0.088 Uiso 1 1 calc R . .
C21 C 0.0826(15) -0.1614(13) 0.5046(15) 0.065(4) Uani 1 1 d . . .
C22 C 0.0097(19) -0.2759(15) 0.5597(16) 0.085(5) Uani 1 1 d . . .
H22A H -0.0474 -0.3361 0.5019 0.128 Uiso 1 1 calc R . .
H22B H -0.0671 -0.2626 0.6082 0.128 Uiso 1 1 calc R . .
H22C H 0.0970 -0.3021 0.6039 0.128 Uiso 1 1 calc R . .
C23 C 0.3490(19) 0.0708(15) 0.1284(17) 0.079(5) Uani 1 1 d . . .
C24 C 0.272(2) 0.0330(19) 0.0128(18) 0.091(6) Uani 1 1 d . . .
H24A H 0.2034 -0.0473 0.0117 0.137 Uiso 1 1 calc R . .
H24B H 0.3562 0.0361 -0.0350 0.137 Uiso 1 1 calc R . .
H24C H 0.2044 0.0851 -0.0149 0.137 Uiso 1 1 calc R . .
N1 N 0.4318(15) 0.3707(12) 0.2888(14) 0.078(4) Uani 1 1 d . . .
N2 N 0.6569(18) 0.4292(13) 0.4447(17) 0.090(5) Uani 1 1 d . . .
N3 N 0.4781(13) 0.2433(11) 0.4936(13) 0.070(4) Uani 1 1 d . . .
O1 O 0.2950(12) 0.1385(10) 0.1871(10) 0.079(3) Uani 1 1 d . . .
O2 O 0.4701(13) 0.0276(10) 0.1646(11) 0.082(3) Uani 1 1 d . . .
Pd1 Pd 0.35748(12) 0.19529(10) 0.34642(12) 0.0719(5) Uani 1 1 d . . .
Pd2 Pd 0.62564(13) 0.07183(11) 0.30313(12) 0.0730(5) Uani 1 1 d . . .
Cl1 Cl 0.7278(8) 0.2351(7) 0.2125(8) 0.160(3) Uani 1 1 d . . .
C16 C 0.2904(15) 0.0096(13) 0.5106(15) 0.062(4) Uani 1 1 d . . .
N4 N 0.4142(13) 0.0681(11) 0.5930(12) 0.068(3) Uani 1 1 d . . .
N5 N 0.2210(15) -0.0890(11) 0.5589(13) 0.075(4) 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'
Cl Cl 0.1484 0.1585 '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 C2 C3 125.0(18) . . ?
N1 C2 C1 123.5(16) . . ?
C3 C2 C1 111.4(19) . . ?
C4 C3 C2 117(2) . . ?
C6 C4 C3 116.7(17) . . ?
C6 C4 C5 122.9(19) . . ?
C3 C4 C5 120(2) . . ?
C4 C6 C7 123.0(19) . . ?
N2 C7 C6 116.6(18) . . ?
N2 C7 N1 124.3(14) . . ?
C6 C7 N1 119(2) . . ?
N2 C8 C9 120.8(15) . . ?
N2 C8 N3 129.7(18) . . ?
C9 C8 N3 109.3(14) . . ?
C10 C9 C14 118.0(19) . . ?
C10 C9 C8 132.4(16) . . ?
C14 C9 C8 109.5(14) . . ?
C11 C10 C9 120.9(18) . . ?
C10 C11 C12 121.4(18) . . ?
C11 C12 C13 117(2) . . ?
C14 C13 C12 120.3(18) . . ?
C13 C14 C9 121.9(16) . . ?
C13 C14 C15 135.1(16) . . ?
C9 C14 C15 103.0(16) . . ?
N3 C15 N4 124.1(15) . . ?
N3 C15 C14 113.0(15) . . ?
N4 C15 C14 122.9(16) . . ?
C16 C17 C18 117.1(14) . . ?
C16 C17 Pd1 122.8(11) . . ?
C18 C17 Pd1 119.9(14) . . ?
C20 C18 C17 115.8(17) . . ?
C20 C18 C19 116.3(14) . . ?
C17 C18 C19 127.8(14) . . ?
C21 C20 C18 122.9(15) . . ?
N5 C21 C20 118.9(14) . . ?
N5 C21 C22 117.6(16) . . ?
C20 C21 C22 123.5(14) . . ?
O1 C23 O2 123.8(19) . . ?
O1 C23 C24 121.1(16) . . ?
O2 C23 C24 115.1(16) . . ?
C2 N1 C7 118.1(16) . . ?
C2 N1 Pd1 122.6(12) . . ?
C7 N1 Pd1 119.2(13) . . ?
C8 N2 C7 128.5(15) . . ?
C15 N3 C8 104.8(14) . . ?
C15 N3 Pd1 130.0(11) . . ?
C8 N3 Pd1 120.5(11) . . ?
C23 O1 Pd1 131.4(12) . . ?
C23 O2 Pd2 128.2(12) . . ?
N3 Pd1 O1 163.4(5) . . ?
N3 Pd1 C17 88.3(7) . . ?
O1 Pd1 C17 95.9(6) . . ?
N3 Pd1 N1 91.7(6) . . ?
O1 Pd1 N1 88.0(6) . . ?
C17 Pd1 N1 166.0(5) . . ?
N3 Pd1 Pd2 87.9(4) . . ?
O1 Pd1 Pd2 76.2(3) . . ?
C17 Pd1 Pd2 87.4(4) . . ?
N1 Pd1 Pd2 106.5(3) . . ?
N5 Pd2 O2 170.8(5) 2_656 . ?
N5 Pd2 N4 64.2(5) 2_656 2_656 ?
O2 Pd2 N4 108.0(5) . 2_656 ?
N5 Pd2 Cl1 103.1(4) 2_656 . ?
O2 Pd2 Cl1 84.1(4) . . ?
N4 Pd2 Cl1 166.7(4) 2_656 . ?
N5 Pd2 C16 31.4(5) 2_656 2_656 ?
O2 Pd2 C16 141.1(5) . 2_656 ?
N4 Pd2 C16 33.1(5) 2_656 2_656 ?
Cl1 Pd2 C16 134.5(4) . 2_656 ?
N5 Pd2 Pd1 107.4(3) 2_656 . ?
O2 Pd2 Pd1 78.6(3) . . ?
N4 Pd2 Pd1 102.6(3) 2_656 . ?
Cl1 Pd2 Pd1 84.8(2) . . ?
C16 Pd2 Pd1 105.3(3) 2_656 . ?
C17 C16 N5 126.4(15) . . ?
C17 C16 N4 130.1(14) . . ?
N5 C16 N4 103.4(15) . . ?
C17 C16 Pd2 175.4(12) . 2_656 ?
N5 C16 Pd2 49.4(9) . 2_656 ?
N4 C16 Pd2 54.3(8) . 2_656 ?
C15 N4 C16 122.0(14) . . ?
C15 N4 Pd2 145.4(12) . 2_656 ?
C16 N4 Pd2 92.6(9) . 2_656 ?
C16 N5 C21 118.7(16) . . ?
C16 N5 Pd2 99.2(11) . 2_656 ?
C21 N5 Pd2 142.0(11) . 2_656 ?
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
C1 C2 1.55(3) . ?
C2 N1 1.26(2) . ?
C2 C3 1.46(3) . ?
C3 C4 1.40(3) . ?
C4 C6 1.38(3) . ?
C4 C5 1.50(2) . ?
C6 C7 1.39(2) . ?
C7 N2 1.39(3) . ?
C7 N1 1.41(2) . ?
C8 N2 1.26(2) . ?
C8 C9 1.42(2) . ?
C8 N3 1.468(18) . ?
C9 C10 1.39(2) . ?
C9 C14 1.41(2) . ?
C10 C11 1.32(3) . ?
C11 C12 1.41(3) . ?
C12 C13 1.42(3) . ?
C13 C14 1.31(2) . ?
C14 C15 1.50(2) . ?
C15 N3 1.34(2) . ?
C15 N4 1.36(2) . ?
C17 C16 1.32(2) . ?
C17 C18 1.45(2) . ?
C17 Pd1 2.046(15) . ?
C18 C20 1.41(2) . ?
C18 C19 1.51(2) . ?
C20 C21 1.36(2) . ?
C21 N5 1.36(2) . ?
C21 C22 1.54(2) . ?
C23 O1 1.28(2) . ?
C23 O2 1.30(2) . ?
C23 C24 1.48(3) . ?
N1 Pd1 2.161(13) . ?
N3 Pd1 1.942(15) . ?
O1 Pd1 1.998(13) . ?
O2 Pd2 1.979(13) . ?
Pd1 Pd2 3.1208(17) . ?
Pd2 N5 1.962(16) 2_656 ?
Pd2 N4 2.074(13) 2_656 ?
Pd2 Cl1 2.266(8) . ?
Pd2 C16 2.550(18) 2_656 ?
C16 N5 1.345(18) . ?
C16 N4 1.39(2) . ?
C16 Pd2 2.550(18) 2_656 ?
N4 Pd2 2.074(13) 2_656 ?
N5 Pd2 1.962(16) 2_656 ?
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C2 C3 C4 -1(3) . . . . ?
C1 C2 C3 C4 175.1(17) . . . . ?
C2 C3 C4 C6 -5(3) . . . . ?
C2 C3 C4 C5 178.5(18) . . . . ?
C3 C4 C6 C7 4(3) . . . . ?
C5 C4 C6 C7 -179.6(18) . . . . ?
C4 C6 C7 N2 -176.3(18) . . . . ?
C4 C6 C7 N1 3(3) . . . . ?
N2 C8 C9 C10 5(3) . . . . ?
N3 C8 C9 C10 -179.7(16) . . . . ?
N2 C8 C9 C14 -176.7(15) . . . . ?
N3 C8 C9 C14 -0.9(18) . . . . ?
C14 C9 C10 C11 0(3) . . . . ?
C8 C9 C10 C11 178.9(18) . . . . ?
C9 C10 C11 C12 -4(3) . . . . ?
C10 C11 C12 C13 5(3) . . . . ?
C11 C12 C13 C14 -2(3) . . . . ?
C12 C13 C14 C9 -2(3) . . . . ?
C12 C13 C14 C15 177.9(17) . . . . ?
C10 C9 C14 C13 3(2) . . . . ?
C8 C9 C14 C13 -176.2(16) . . . . ?
C10 C9 C14 C15 -177.0(14) . . . . ?
C8 C9 C14 C15 4.0(17) . . . . ?
C13 C14 C15 N3 174.0(18) . . . . ?
C9 C14 C15 N3 -6.3(16) . . . . ?
C13 C14 C15 N4 -9(3) . . . . ?
C9 C14 C15 N4 171.2(13) . . . . ?
C16 C17 C18 C20 -4(2) . . . . ?
Pd1 C17 C18 C20 -179.1(10) . . . . ?
C16 C17 C18 C19 173.2(15) . . . . ?
Pd1 C17 C18 C19 -2(2) . . . . ?
C17 C18 C20 C21 0(2) . . . . ?
C19 C18 C20 C21 -176.9(14) . . . . ?
C18 C20 C21 N5 2(2) . . . . ?
C18 C20 C21 C22 -176.6(14) . . . . ?
C3 C2 N1 C7 9(3) . . . . ?
C1 C2 N1 C7 -167.4(16) . . . . ?
C3 C2 N1 Pd1 -167.6(14) . . . . ?
C1 C2 N1 Pd1 16(3) . . . . ?
N2 C7 N1 C2 169.9(16) . . . . ?
C6 C7 N1 C2 -10(2) . . . . ?
N2 C7 N1 Pd1 -14(2) . . . . ?
C6 C7 N1 Pd1 166.9(13) . . . . ?
C9 C8 N2 C7 -179.0(16) . . . . ?
N3 C8 N2 C7 6(3) . . . . ?
C6 C7 N2 C8 174.2(18) . . . . ?
N1 C7 N2 C8 -5(3) . . . . ?
N4 C15 N3 C8 -171.7(13) . . . . ?
C14 C15 N3 C8 5.8(16) . . . . ?
N4 C15 N3 Pd1 -17(2) . . . . ?
C14 C15 N3 Pd1 160.8(10) . . . . ?
N2 C8 N3 C15 172.2(17) . . . . ?
C9 C8 N3 C15 -3.0(17) . . . . ?
N2 C8 N3 Pd1 14(2) . . . . ?
C9 C8 N3 Pd1 -161.0(10) . . . . ?
O2 C23 O1 Pd1 -4(2) . . . . ?
C24 C23 O1 Pd1 174.5(11) . . . . ?
O1 C23 O2 Pd2 -12(2) . . . . ?
C24 C23 O2 Pd2 170.3(11) . . . . ?
C15 N3 Pd1 O1 -86(2) . . . . ?
C8 N3 Pd1 O1 66(2) . . . . ?
C15 N3 Pd1 C17 18.9(12) . . . . ?
C8 N3 Pd1 C17 170.7(11) . . . . ?
C15 N3 Pd1 N1 -175.1(12) . . . . ?
C8 N3 Pd1 N1 -23.3(11) . . . . ?
C15 N3 Pd1 Pd2 -68.6(11) . . . . ?
C8 N3 Pd1 Pd2 83.2(11) . . . . ?
C23 O1 Pd1 N3 27(2) . . . . ?
C23 O1 Pd1 C17 -76.5(13) . . . . ?
C23 O1 Pd1 N1 116.9(12) . . . . ?
C23 O1 Pd1 Pd2 9.4(11) . . . . ?
C16 C17 Pd1 N3 -13.0(12) . . . . ?
C18 C17 Pd1 N3 162.0(11) . . . . ?
C16 C17 Pd1 O1 150.8(12) . . . . ?
C18 C17 Pd1 O1 -34.1(11) . . . . ?
C16 C17 Pd1 N1 -103(3) . . . . ?
C18 C17 Pd1 N1 72(3) . . . . ?
C16 C17 Pd1 Pd2 75.0(12) . . . . ?
C18 C17 Pd1 Pd2 -110.0(10) . . . . ?
C2 N1 Pd1 N3 -159.9(14) . . . . ?
C7 N1 Pd1 N3 23.8(12) . . . . ?
C2 N1 Pd1 O1 36.7(14) . . . . ?
C7 N1 Pd1 O1 -139.6(12) . . . . ?
C2 N1 Pd1 C17 -70(3) . . . . ?
C7 N1 Pd1 C17 114(3) . . . . ?
C2 N1 Pd1 Pd2 111.7(14) . . . . ?
C7 N1 Pd1 Pd2 -64.6(12) . . . . ?
C23 O2 Pd2 N5 144(2) . . . 2_656 ?
C23 O2 Pd2 N4 112.7(12) . . . 2_656 ?
C23 O2 Pd2 Cl1 -72.9(12) . . . . ?
C23 O2 Pd2 C16 113.3(13) . . . 2_656 ?
C23 O2 Pd2 Pd1 13.0(11) . . . . ?
N3 Pd1 Pd2 N5 3.6(5) . . . 2_656 ?
O1 Pd1 Pd2 N5 178.5(5) . . . 2_656 ?
C17 Pd1 Pd2 N5 -84.8(7) . . . 2_656 ?
N1 Pd1 Pd2 N5 94.8(6) . . . 2_656 ?
N3 Pd1 Pd2 O2 176.4(5) . . . . ?
O1 Pd1 Pd2 O2 -8.7(4) . . . . ?
C17 Pd1 Pd2 O2 88.0(6) . . . . ?
N1 Pd1 Pd2 O2 -92.4(6) . . . . ?
N3 Pd1 Pd2 N4 70.2(5) . . . 2_656 ?
O1 Pd1 Pd2 N4 -114.9(5) . . . 2_656 ?
C17 Pd1 Pd2 N4 -18.2(7) . . . 2_656 ?
N1 Pd1 Pd2 N4 161.4(6) . . . 2_656 ?
N3 Pd1 Pd2 Cl1 -98.6(4) . . . . ?
O1 Pd1 Pd2 Cl1 76.3(4) . . . . ?
C17 Pd1 Pd2 Cl1 173.0(6) . . . . ?
N1 Pd1 Pd2 Cl1 -7.4(5) . . . . ?
N3 Pd1 Pd2 C16 36.2(5) . . . 2_656 ?
O1 Pd1 Pd2 C16 -148.9(5) . . . 2_656 ?
C17 Pd1 Pd2 C16 -52.2(7) . . . 2_656 ?
N1 Pd1 Pd2 C16 127.4(6) . . . 2_656 ?
C18 C17 C16 N5 5(2) . . . . ?
Pd1 C17 C16 N5 -179.7(11) . . . . ?
C18 C17 C16 N4 -169.2(14) . . . . ?
Pd1 C17 C16 N4 6(2) . . . . ?
C18 C17 C16 Pd2 28(13) . . . 2_656 ?
Pd1 C17 C16 Pd2 -157(12) . . . 2_656 ?
N3 C15 N4 C16 2(2) . . . . ?
C14 C15 N4 C16 -175.2(13) . . . . ?
N3 C15 N4 Pd2 -176.0(12) . . . 2_656 ?
C14 C15 N4 Pd2 7(2) . . . 2_656 ?
C17 C16 N4 C15 3(2) . . . . ?
N5 C16 N4 C15 -172.5(12) . . . . ?
Pd2 C16 N4 C15 -178.8(15) 2_656 . . . ?
C17 C16 N4 Pd2 -178.4(15) . . . 2_656 ?
N5 C16 N4 Pd2 6.3(10) . . . 2_656 ?
C17 C16 N5 C21 -3(2) . . . . ?
N4 C16 N5 C21 172.9(12) . . . . ?
Pd2 C16 N5 C21 179.7(15) 2_656 . . . ?
C17 C16 N5 Pd2 177.7(13) . . . 2_656 ?
N4 C16 N5 Pd2 -6.8(11) . . . 2_656 ?
C20 C21 N5 C16 -1(2) . . . . ?
C22 C21 N5 C16 177.6(13) . . . . ?
C20 C21 N5 Pd2 178.3(12) . . . 2_656 ?
C22 C21 N5 Pd2 -3(2) . . . 2_656 ?
