# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2022

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_rmadam_pd_0m
_database_code_depnum_ccdc_archive 'CCDC 2163759'
loop_
_audit_author_name
_audit_author_address
'Dr. Ramananda Maity'
;University of Calcutta
India
;
_audit_update_record             
;
2022-06-02 deposited with the CCDC.	2022-06-09 downloaded from the CCDC.
;
_audit_creation_date             2022-01-13
_audit_creation_method           
;
Olex2 1.5
(compiled 2021.12.09 svn.r5202d8cf for OlexSys, GUI svn.r6439)
;
_shelx_SHELXL_version_number     2016/6
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C28 H32 I4 N6 O2 Pd2'
_chemical_formula_sum            'C28 H32 I4 N6 O2 Pd2'
_chemical_formula_weight         1204.99
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
I I -0.3257 6.8362 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pd Pd 0.1215 3.9337 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   9.3535(8)
_cell_length_b                   23.046(2)
_cell_length_c                   17.3965(15)
_cell_angle_alpha                90
_cell_angle_beta                 102.035(4)
_cell_angle_gamma                90
_cell_volume                     3667.6(6)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9921
_cell_measurement_temperature    113.0
_cell_measurement_theta_max      63.63
_cell_measurement_theta_min      3.23
_shelx_estimated_absorpt_T_max   0.103
_shelx_estimated_absorpt_T_min   0.025
_exptl_absorpt_coefficient_mu    34.615
_exptl_absorpt_correction_T_max  0.7524
_exptl_absorpt_correction_T_min  0.2686
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1649 before and 0.1206 after correction. The Ratio of minimum to maximum transmission is 0.3570. The λ/2 correction factor is Not present.'
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear yellowish orange'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   yellowish
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    2.182
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       needle
_exptl_crystal_F_000             2248
_exptl_crystal_size_max          0.4
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.12
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.1091
_diffrn_reflns_av_unetI/netI     0.0618
_diffrn_reflns_Laue_measured_fraction_full 0.991
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       26
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            50498
_diffrn_reflns_point_group_measured_fraction_full 0.991
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_theta_full        63.917
_diffrn_reflns_theta_max         63.917
_diffrn_reflns_theta_min         3.229
_diffrn_ambient_temperature      113.0
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   ?
_diffrn_source_current           1.2
_diffrn_source_power             0.06
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                5373
_reflns_number_total             6015
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.40B (?, 2016)'
_computing_data_collection       'SAINT V8.40B (Bruker, 2016)'
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'XT  (Sheldrick, 2015)'
_refine_diff_density_max         1.618
_refine_diff_density_min         -1.987
_refine_diff_density_rms         0.283
_refine_ls_extinction_coef       0.00028(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2016/6 (Sheldrick 2016)'
_refine_ls_goodness_of_fit_ref   1.091
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     386
_refine_ls_number_reflns         6015
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0695
_refine_ls_R_factor_gt           0.0637
_refine_ls_restrained_S_all      1.091
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0826P)²+40.1621P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1581
_refine_ls_wR_factor_ref         0.1629
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Aromatic/amide H refined with riding coordinates:
 C26(H26), C25(H25), C22(H22), C6(H6), C5(H5), C18(H18), C17(H17), C23(H23),
 C13(H13), C12(H12), C21(H21), C3(H3), C2(H2), C20(H20)
2.b Idealised Me refined as rotating group:
 C15(H15A,H15B,H15C), C10(H10A,H10B,H10C), C27(H27A,H27B,H27C), C16(H16A,H16B,
 H16C), C11(H11A,H11B,H11C), C28(H28A,H28B,H28C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
I1 I 0.94052(7) 0.59744(3) 0.86536(4) 0.0304(2) Uani 1 1 d . . . . .
I2 I 0.39434(8) 0.53790(3) 0.78555(4) 0.0316(2) Uani 1 1 d . . . . .
I4 I 0.88616(8) 0.85942(3) 0.71622(5) 0.0335(2) Uani 1 1 d . . . . .
Pd1 Pd 0.66368(8) 0.57303(3) 0.82122(4) 0.0223(2) Uani 1 1 d . . . . .
I3 I 0.41537(8) 0.74094(3) 0.60189(5) 0.0379(3) Uani 1 1 d . . . . .
Pd2 Pd 0.65887(9) 0.79302(3) 0.66424(4) 0.0256(2) Uani 1 1 d . . . . .
N2 N 0.6004(10) 0.6412(4) 0.9547(6) 0.028(2) Uani 1 1 d . . . . .
N6 N 0.6812(9) 0.5600(4) 0.7053(5) 0.0229(19) Uani 1 1 d . . . . .
O1 O 0.6930(11) 0.5362(4) 0.4694(5) 0.044(2) Uani 1 1 d . . . . .
N3 N 0.4980(10) 0.8456(4) 0.7762(5) 0.027(2) Uani 1 1 d . . . . .
N1 N 0.6555(10) 0.5543(4) 0.9903(5) 0.025(2) Uani 1 1 d . . . . .
N4 N 0.4960(10) 0.9022(4) 0.6776(5) 0.029(2) Uani 1 1 d . . . . .
C1 C 0.5425(11) 0.8503(5) 0.7063(6) 0.026(2) Uani 1 1 d . . . . .
O2 O 1.0581(11) 0.6165(4) 0.5390(5) 0.050(2) Uani 1 1 d . . . . .
N5 N 0.7873(10) 0.7312(4) 0.6230(5) 0.031(2) Uani 1 1 d . . . . .
C24 C 0.6831(13) 0.5460(5) 0.5461(7) 0.035(3) Uani 1 1 d . . . . .
C26 C 0.6045(12) 0.5943(5) 0.6489(7) 0.028(2) Uani 1 1 d . . . . .
H26 H 0.547185 0.624136 0.665125 0.034 Uiso 1 1 calc R U . . .
C25 C 0.6018(11) 0.5901(5) 0.5707(6) 0.023(2) Uani 1 1 d . . . . .
H25 H 0.546419 0.616415 0.534208 0.027 Uiso 1 1 calc R U . . .
C22 C 0.7646(13) 0.5185(6) 0.6806(7) 0.035(3) Uani 1 1 d . . . . .
H22 H 0.822449 0.494189 0.718916 0.041 Uiso 1 1 calc R U . . .
C6 C 0.6854(12) 0.7279(5) 0.9009(6) 0.029(3) Uani 1 1 d . . . . .
H6 H 0.781906 0.716175 0.924612 0.035 Uiso 1 1 calc R U . . .
C5 C 0.6626(12) 0.7796(5) 0.8592(7) 0.032(3) Uani 1 1 d . . . . .
H5 H 0.741658 0.804489 0.855140 0.039 Uiso 1 1 calc R U . . .
C4 C 0.5167(11) 0.7937(5) 0.8228(7) 0.028(2) Uani 1 1 d . . . . .
C7 C 0.5693(11) 0.6939(5) 0.9080(6) 0.024(2) Uani 1 1 d . . . . .
C8 C 0.4270(12) 0.7086(5) 0.8760(6) 0.029(3) Uani 1 1 d . . . . .
C18 C 0.9733(12) 0.6581(5) 0.6504(7) 0.029(3) Uani 1 1 d . . . . .
H18 H 1.035596 0.634756 0.688156 0.035 Uiso 1 1 calc R U . . .
C15 C 0.7026(13) 0.4931(5) 0.9887(7) 0.036(3) Uani 1 1 d . . . . .
H15A H 0.655110 0.475271 0.938716 0.055 Uiso 1 1 calc R U . . .
H15B H 0.674877 0.471859 1.032223 0.055 Uiso 1 1 calc R U . . .
H15C H 0.808921 0.491482 0.994162 0.055 Uiso 1 1 calc R U . . .
C17 C 0.8800(13) 0.6987(5) 0.6728(7) 0.034(3) Uani 1 1 d . . . . .
H17 H 0.882979 0.703463 0.727362 0.041 Uiso 1 1 calc R U . . .
C14 C 0.6374(11) 0.5903(5) 0.9280(6) 0.025(2) Uani 1 1 d . . . . .
C23 C 0.7697(13) 0.5099(5) 0.6024(7) 0.034(3) Uani 1 1 d . . . . .
H23 H 0.829717 0.480588 0.587324 0.041 Uiso 1 1 calc R U . . .
C19 C 0.9723(14) 0.6530(5) 0.5702(7) 0.037(3) Uani 1 1 d . . . . .
C13 C 0.6259(12) 0.5826(5) 1.0571(7) 0.030(3) Uani 1 1 d . . . . .
H13 H 0.628939 0.566256 1.107474 0.037 Uiso 1 1 calc R U . . .
C12 C 0.5929(12) 0.6373(5) 1.0348(6) 0.029(3) Uani 1 1 d . . . . .
H12 H 0.568837 0.667754 1.066671 0.035 Uiso 1 1 calc R U . . .
C9 C 0.3982(11) 0.7600(5) 0.8302(7) 0.027(3) Uani 1 1 d . . . . .
C21 C 0.7848(15) 0.7243(5) 0.5472(7) 0.039(3) Uani 1 1 d . . . . .
H21 H 0.718628 0.747174 0.510475 0.047 Uiso 1 1 calc R U . . .
C10 C 0.2444(12) 0.7745(6) 0.7879(8) 0.039(3) Uani 1 1 d . . . . .
H10A H 0.189755 0.790161 0.825606 0.059 Uiso 1 1 calc R U . . .
H10B H 0.196014 0.739318 0.763737 0.059 Uiso 1 1 calc R U . . .
H10C H 0.247663 0.803467 0.747100 0.059 Uiso 1 1 calc R U . . .
C3 C 0.4232(14) 0.8950(5) 0.7905(8) 0.038(3) Uani 1 1 d . . . . .
H3 H 0.380223 0.902290 0.834477 0.045 Uiso 1 1 calc R U . . .
C27 C 0.6000(17) 0.5686(6) 0.4112(7) 0.045(3) Uani 1 1 d . . . . .
H27A H 0.596326 0.550638 0.359792 0.068 Uiso 1 1 calc R U . . .
H27B H 0.637085 0.608309 0.410902 0.068 Uiso 1 1 calc R U . . .
H27C H 0.501525 0.569320 0.422409 0.068 Uiso 1 1 calc R U . . .
C16 C 0.5175(14) 0.9233(6) 0.6037(8) 0.043(3) Uani 1 1 d . . . . .
H16A H 0.619880 0.917763 0.600235 0.065 Uiso 1 1 calc R U . . .
H16B H 0.493491 0.964757 0.599086 0.065 Uiso 1 1 calc R U . . .
H16C H 0.454040 0.902040 0.561063 0.065 Uiso 1 1 calc R U . . .
C2 C 0.4239(13) 0.9299(6) 0.7299(8) 0.042(3) Uani 1 1 d . . . . .
H2 H 0.382225 0.967651 0.723211 0.050 Uiso 1 1 calc R U . . .
C11 C 0.2965(13) 0.6708(6) 0.8862(9) 0.045(3) Uani 1 1 d . . . . .
H11A H 0.272546 0.643358 0.842385 0.067 Uiso 1 1 calc R U . . .
H11B H 0.211748 0.695672 0.886925 0.067 Uiso 1 1 calc R U . . .
H11C H 0.321983 0.649336 0.935813 0.067 Uiso 1 1 calc R U . . .
C20 C 0.8733(16) 0.6858(6) 0.5192(7) 0.043(3) Uani 1 1 d . . . . .
H20 H 0.866013 0.681881 0.464147 0.052 Uiso 1 1 calc R U . . .
C28 C 1.1689(16) 0.5844(7) 0.5944(9) 0.054(4) Uani 1 1 d . . . . .
H28A H 1.223529 0.559269 0.565221 0.081 Uiso 1 1 calc R U . . .
H28B H 1.121328 0.560526 0.628405 0.081 Uiso 1 1 calc R U . . .
H28C H 1.236205 0.611707 0.626578 0.081 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
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
I1 Pd1 2.6043(10) . ?
I2 Pd1 2.5953(10) . ?
I4 Pd2 2.6225(11) . ?
Pd1 N6 2.078(9) . ?
Pd1 C14 1.965(11) . ?
I3 Pd2 2.6028(11) . ?
Pd2 C1 1.947(11) . ?
Pd2 N5 2.085(10) . ?
N2 C7 1.455(14) . ?
N2 C14 1.333(15) . ?
N2 C12 1.413(14) . ?
N6 C26 1.347(14) . ?
N6 C22 1.358(15) . ?
O1 C24 1.374(14) . ?
O1 C27 1.403(15) . ?
N3 C1 1.370(15) . ?
N3 C4 1.434(15) . ?
N3 C3 1.384(15) . ?
N1 C15 1.481(16) . ?
N1 C14 1.347(14) . ?
N1 C13 1.409(15) . ?
N4 C1 1.334(14) . ?
N4 C16 1.428(15) . ?
N4 C2 1.395(16) . ?
O2 C19 1.351(15) . ?
O2 C28 1.461(16) . ?
N5 C17 1.322(14) . ?
N5 C21 1.325(15) . ?
C24 C25 1.390(16) . ?
C24 C23 1.405(16) . ?
C26 H26 0.9500 . ?
C26 C25 1.358(15) . ?
C25 H25 0.9500 . ?
C22 H22 0.9500 . ?
C22 C23 1.385(16) . ?
C6 H6 0.9500 . ?
C6 C5 1.389(16) . ?
C6 C7 1.365(15) . ?
C5 H5 0.9500 . ?
C5 C4 1.417(15) . ?
C4 C9 1.382(16) . ?
C7 C8 1.374(15) . ?
C8 C9 1.422(17) . ?
C8 C11 1.539(17) . ?
C18 H18 0.9500 . ?
C18 C17 1.390(17) . ?
C18 C19 1.397(17) . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C17 H17 0.9500 . ?
C23 H23 0.9500 . ?
C19 C20 1.370(18) . ?
C13 H13 0.9500 . ?
C13 C12 1.335(17) . ?
C12 H12 0.9500 . ?
C9 C10 1.510(15) . ?
C21 H21 0.9500 . ?
C21 C20 1.371(18) . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C3 H3 0.9500 . ?
C3 C2 1.329(19) . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C2 H2 0.9500 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C20 H20 0.9500 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?

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
I2 Pd1 I1 173.64(4) . . ?
N6 Pd1 I1 92.4(2) . . ?
N6 Pd1 I2 89.5(2) . . ?
C14 Pd1 I1 89.4(3) . . ?
C14 Pd1 I2 89.0(3) . . ?
C14 Pd1 N6 175.7(4) . . ?
I3 Pd2 I4 171.42(4) . . ?
C1 Pd2 I4 87.2(3) . . ?
C1 Pd2 I3 87.7(3) . . ?
C1 Pd2 N5 178.1(4) . . ?
N5 Pd2 I4 91.9(3) . . ?
N5 Pd2 I3 93.3(3) . . ?
C14 N2 C7 125.1(9) . . ?
C14 N2 C12 110.9(9) . . ?
C12 N2 C7 124.0(9) . . ?
C26 N6 Pd1 119.0(8) . . ?
C26 N6 C22 115.8(9) . . ?
C22 N6 Pd1 125.2(7) . . ?
C24 O1 C27 117.1(10) . . ?
C1 N3 C4 122.8(9) . . ?
C1 N3 C3 110.8(9) . . ?
C3 N3 C4 126.2(10) . . ?
C14 N1 C15 124.1(10) . . ?
C14 N1 C13 111.3(9) . . ?
C13 N1 C15 124.5(9) . . ?
C1 N4 C16 123.1(10) . . ?
C1 N4 C2 109.4(10) . . ?
C2 N4 C16 127.5(11) . . ?
N3 C1 Pd2 125.3(8) . . ?
N4 C1 Pd2 129.2(8) . . ?
N4 C1 N3 105.4(10) . . ?
C19 O2 C28 116.7(10) . . ?
C17 N5 Pd2 120.5(8) . . ?
C17 N5 C21 117.3(11) . . ?
C21 N5 Pd2 122.1(8) . . ?
O1 C24 C25 124.8(11) . . ?
O1 C24 C23 115.7(11) . . ?
C25 C24 C23 119.3(11) . . ?
N6 C26 H26 117.1 . . ?
N6 C26 C25 125.7(11) . . ?
C25 C26 H26 117.1 . . ?
C24 C25 H25 121.2 . . ?
C26 C25 C24 117.7(10) . . ?
C26 C25 H25 121.2 . . ?
N6 C22 H22 118.3 . . ?
N6 C22 C23 123.5(10) . . ?
C23 C22 H22 118.3 . . ?
C5 C6 H6 120.0 . . ?
C7 C6 H6 120.0 . . ?
C7 C6 C5 120.1(11) . . ?
C6 C5 H5 121.3 . . ?
C6 C5 C4 117.4(11) . . ?
C4 C5 H5 121.3 . . ?
C5 C4 N3 115.9(10) . . ?
C9 C4 N3 121.1(10) . . ?
C9 C4 C5 123.0(11) . . ?
C6 C7 N2 117.3(9) . . ?
C6 C7 C8 122.9(11) . . ?
C8 C7 N2 119.7(10) . . ?
C7 C8 C9 119.1(10) . . ?
C7 C8 C11 122.6(11) . . ?
C9 C8 C11 118.3(10) . . ?
C17 C18 H18 121.2 . . ?
C17 C18 C19 117.6(11) . . ?
C19 C18 H18 121.2 . . ?
N1 C15 H15A 109.5 . . ?
N1 C15 H15B 109.5 . . ?
N1 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
N5 C17 C18 124.1(11) . . ?
N5 C17 H17 117.9 . . ?
C18 C17 H17 117.9 . . ?
N2 C14 Pd1 126.9(8) . . ?
N2 C14 N1 105.1(9) . . ?
N1 C14 Pd1 128.0(9) . . ?
C24 C23 H23 121.1 . . ?
C22 C23 C24 117.8(11) . . ?
C22 C23 H23 121.1 . . ?
O2 C19 C18 125.0(11) . . ?
O2 C19 C20 117.4(11) . . ?
C20 C19 C18 117.6(12) . . ?
N1 C13 H13 127.1 . . ?
C12 C13 N1 105.7(10) . . ?
C12 C13 H13 127.1 . . ?
N2 C12 H12 126.6 . . ?
C13 C12 N2 106.9(10) . . ?
C13 C12 H12 126.6 . . ?
C4 C9 C8 117.4(10) . . ?
C4 C9 C10 122.1(11) . . ?
C8 C9 C10 120.5(10) . . ?
N5 C21 H21 118.5 . . ?
N5 C21 C20 123.0(11) . . ?
C20 C21 H21 118.5 . . ?
C9 C10 H10A 109.5 . . ?
C9 C10 H10B 109.5 . . ?
C9 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
N3 C3 H3 127.2 . . ?
C2 C3 N3 105.6(11) . . ?
C2 C3 H3 127.2 . . ?
O1 C27 H27A 109.5 . . ?
O1 C27 H27B 109.5 . . ?
O1 C27 H27C 109.5 . . ?
H27A C27 H27B 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
N4 C16 H16A 109.5 . . ?
N4 C16 H16B 109.5 . . ?
N4 C16 H16C 109.5 . . ?
H16A C16 H16B 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
N4 C2 H2 125.6 . . ?
C3 C2 N4 108.8(11) . . ?
C3 C2 H2 125.6 . . ?
C8 C11 H11A 109.5 . . ?
C8 C11 H11B 109.5 . . ?
C8 C11 H11C 109.5 . . ?
H11A C11 H11B 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C19 C20 C21 120.3(12) . . ?
C19 C20 H20 119.8 . . ?
C21 C20 H20 119.8 . . ?
O2 C28 H28A 109.5 . . ?
O2 C28 H28B 109.5 . . ?
O2 C28 H28C 109.5 . . ?
H28A C28 H28B 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Pd1 N6 C26 C25 -178.2(9) . . . . ?
Pd1 N6 C22 C23 177.8(9) . . . . ?
Pd2 N5 C17 C18 -177.5(9) . . . . ?
Pd2 N5 C21 C20 176.9(10) . . . . ?
N2 C7 C8 C9 -179.6(10) . . . . ?
N2 C7 C8 C11 -1.1(17) . . . . ?
N6 C26 C25 C24 1.2(18) . . . . ?
N6 C22 C23 C24 -0.3(19) . . . . ?
O1 C24 C25 C26 -179.3(11) . . . . ?
O1 C24 C23 C22 179.3(11) . . . . ?
N3 C4 C9 C8 178.7(10) . . . . ?
N3 C4 C9 C10 2.1(17) . . . . ?
N3 C3 C2 N4 1.1(14) . . . . ?
N1 C13 C12 N2 0.9(12) . . . . ?
C1 N3 C4 C5 69.5(14) . . . . ?
C1 N3 C4 C9 -109.9(13) . . . . ?
C1 N3 C3 C2 -0.9(14) . . . . ?
C1 N4 C2 C3 -1.1(14) . . . . ?
O2 C19 C20 C21 -178.9(13) . . . . ?
N5 C21 C20 C19 -1(2) . . . . ?
C26 N6 C22 C23 -1.8(17) . . . . ?
C25 C24 C23 C22 2.9(18) . . . . ?
C22 N6 C26 C25 1.4(16) . . . . ?
C6 C5 C4 N3 -176.4(10) . . . . ?
C6 C5 C4 C9 2.9(18) . . . . ?
C6 C7 C8 C9 3.2(17) . . . . ?
C6 C7 C8 C11 -178.3(11) . . . . ?
C5 C6 C7 N2 -178.0(10) . . . . ?
C5 C6 C7 C8 -0.8(18) . . . . ?
C5 C4 C9 C8 -0.6(17) . . . . ?
C5 C4 C9 C10 -177.2(11) . . . . ?
C4 N3 C1 Pd2 -8.3(15) . . . . ?
C4 N3 C1 N4 174.9(9) . . . . ?
C4 N3 C3 C2 -175.3(10) . . . . ?
C7 N2 C14 Pd1 1.4(15) . . . . ?
C7 N2 C14 N1 -179.9(9) . . . . ?
C7 N2 C12 C13 179.0(9) . . . . ?
C7 C6 C5 C4 -2.2(18) . . . . ?
C7 C8 C9 C4 -2.4(16) . . . . ?
C7 C8 C9 C10 174.3(11) . . . . ?
C18 C19 C20 C21 3(2) . . . . ?
C15 N1 C14 Pd1 1.0(15) . . . . ?
C15 N1 C14 N2 -177.7(9) . . . . ?
C15 N1 C13 C12 177.6(10) . . . . ?
C17 N5 C21 C20 0(2) . . . . ?
C17 C18 C19 O2 178.7(12) . . . . ?
C17 C18 C19 C20 -3.7(18) . . . . ?
C14 N2 C7 C6 -85.3(14) . . . . ?
C14 N2 C7 C8 97.4(13) . . . . ?
C14 N2 C12 C13 -0.1(13) . . . . ?
C14 N1 C13 C12 -1.5(12) . . . . ?
C23 C24 C25 C26 -3.3(17) . . . . ?
C19 C18 C17 N5 2.4(18) . . . . ?
C13 N1 C14 Pd1 -179.9(7) . . . . ?
C13 N1 C14 N2 1.4(11) . . . . ?
C12 N2 C7 C6 95.7(13) . . . . ?
C12 N2 C7 C8 -81.6(13) . . . . ?
C12 N2 C14 Pd1 -179.6(7) . . . . ?
C12 N2 C14 N1 -0.8(12) . . . . ?
C21 N5 C17 C18 -0.3(19) . . . . ?
C3 N3 C1 Pd2 177.1(8) . . . . ?
C3 N3 C1 N4 0.2(12) . . . . ?
C3 N3 C4 C5 -116.7(13) . . . . ?
C3 N3 C4 C9 63.9(16) . . . . ?
C27 O1 C24 C25 -8.5(19) . . . . ?
C27 O1 C24 C23 175.4(12) . . . . ?
C16 N4 C1 Pd2 4.8(17) . . . . ?
C16 N4 C1 N3 -178.4(10) . . . . ?
C16 N4 C2 C3 177.8(12) . . . . ?
C2 N4 C1 Pd2 -176.2(8) . . . . ?
C2 N4 C1 N3 0.5(12) . . . . ?
C11 C8 C9 C4 179.0(11) . . . . ?
C11 C8 C9 C10 -4.3(16) . . . . ?
C28 O2 C19 C18 -6(2) . . . . ?
C28 O2 C19 C20 176.5(13) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
