# Supplementary Material (ESI) for Journal of Materials Chemistry
# This journal is © The Royal Society of Chemistry 
# and the Centre National de la Recherche Scientifique 1999
# CCDC Number: 440/131
data_meso-2a

_audit_creation_method SHELXL 
_chemical_name_systematic 
; 
?  
;
_chemical_name_common ?  
_chemical_formula_moiety ?
_chemical_formula_structural ?  
_chemical_formula_analytical ?
_chemical_formula_sum 'C40 H40 Cl2 F12 N2 P4 Pd'
_chemical_formula_weight 1077.96 
_chemical_melting_point ?
_chemical_compound_source ?

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'
 'F'  'F'   0.0171   0.0103
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'P'  'P'   0.1023   0.0942
 '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'
 'N'  'N'   0.0061   0.0033
 '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'

_symmetry_cell_setting            ?
_symmetry_space_group_name_H-M    ?

loop_
 _symmetry_equiv_pos_as_xyz
 'x, y, z'
 '-x+1/2, y+1/2, -z'
 '-x, -y, -z'
 'x-1/2, -y-1/2, z'

_cell_length_a                    16.085(5)
_cell_length_b                    14.361(5)
_cell_length_c                    19.564(5)
_cell_angle_alpha                 90.000(5)
_cell_angle_beta                  94.390(5)
_cell_angle_gamma                 90.000(5)
_cell_volume                      4506(2)
_cell_formula_units_Z             4
_cell_measurement_temperature     293(2)
_cell_measurement_reflns_used     ?
_cell_measurement_theta_min       ?
_cell_measurement_theta_max       ?

_exptl_crystal_description        ?
_exptl_crystal_colour             ?
_exptl_crystal_size_max           ?
_exptl_crystal_size_mid           ?
_exptl_crystal_size_min           ?
_exptl_crystal_density_meas       ?
_exptl_crystal_density_diffrn     1.580
_exptl_crystal_density_method     ?
_exptl_crystal_F_000              2232
_exptl_absorpt_coefficient_mu     0.745
_exptl_absorpt_correction_type    ?
_exptl_absorpt_correction_T_min   ?
_exptl_absorpt_correction_T_max   ?

_exptl_special_details
;
 ?
;

_diffrn_ambient_temperature       293(2)
_diffrn_radiation_wavelength      0.71069
_diffrn_radiation_type            MoK\a
_diffrn_radiation_source          'fine-focus sealed tube'
_diffrn_radiation_monochromator   graphite
_diffrn_measurement_device        ?
_diffrn_measurement_method        ?
_diffrn_standards_number          ?
_diffrn_standards_interval_count  ?
_diffrn_standards_interval_time   ?
_diffrn_standards_decay_%         ?
_diffrn_reflns_number             8152
_diffrn_reflns_av_R_equivalents   0.1003
_diffrn_reflns_av_sigmaI/netI     0.2136
_diffrn_reflns_limit_h_min        -19
_diffrn_reflns_limit_h_max        19
_diffrn_reflns_limit_k_min        0
_diffrn_reflns_limit_k_max        17
_diffrn_reflns_limit_l_min        0
_diffrn_reflns_limit_l_max        23
_diffrn_reflns_theta_min          1.76
_diffrn_reflns_theta_max          24.99
_reflns_number_total              7906
_reflns_number_observed           3718
_reflns_observed_criterion        >2sigma(I)

_computing_data_collection        ?
_computing_cell_refinement        ?
_computing_data_reduction         ?
_computing_structure_solution     'SHELXS-96 (Sheldrick, 1990)'
_computing_structure_refinement   'SHELXL-96 (Sheldrick, 1996)'
_computing_molecular_graphics     ?
_computing_publication_material   ?

_refine_special_details
;
 Refinement of F^2^ against ALL reflections.  Weighted R-factors wR and all
 goodnesses of fit S are based on F^2^, conventional R-factors R
 are based on F, with F set to zero for negative F^2^. The observed criterion
 of F^2^ > 2sigma(F^2^) is used only for calculating _R_factor_obs etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F^2^ are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;

_refine_ls_structure_factor_coef  Fsqd
_refine_ls_matrix_type            full
_refine_ls_weighting_scheme
 'calc w=1/[\s^2^(Fo^2^)+(0.1279P)^2^+4.0165P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary      direct
_atom_sites_solution_secondary    difmap
_atom_sites_solution_hydrogens    geom
_refine_ls_hydrogen_treatment     ?
_refine_ls_extinction_method      none
_refine_ls_extinction_coef        ?
_refine_ls_number_reflns          7906
_refine_ls_number_parameters      477
_refine_ls_number_restraints      0
_refine_ls_R_factor_all           0.2424
_refine_ls_R_factor_obs           0.0880
_refine_ls_wR_factor_all          0.2730
_refine_ls_wR_factor_obs          0.2134
_refine_ls_goodness_of_fit_all    1.037
_refine_ls_goodness_of_fit_obs    1.213
_refine_ls_restrained_S_all       1.037
_refine_ls_restrained_S_obs       1.213
_refine_ls_shift/esd_max          14.157
_refine_ls_shift/esd_mean         0.124

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_thermal_displace_type
 _atom_site_occupancy
 _atom_site_calc_flag
 _atom_site_refinement_flags
 _atom_site_disorder_group
Pd1 Pd 0.44258(6) 0.26868(7) 0.27684(5) 0.0357(3) Uani 1 d . .
P1 P 0.3473(2) 0.1787(2) 0.21643(17) 0.0379(8) Uani 1 d . .
P2 P 0.3971(2) 0.3904(2) 0.20855(17) 0.0388(8) Uani 1 d . .
N1 N 0.5196(7) 0.3450(8) 0.3498(6) 0.046(3) Uani 1 d . .
N2 N 0.5069(6) 0.1617(7) 0.3355(6) 0.043(3) Uani 1 d . .
C1 C 0.2409(8) 0.2273(11) 0.1952(7) 0.055(4) Uani 1 d . .
H1 H 0.2172 0.1902 0.1563 0.06(2) Uiso 1 calc R .
C2 C 0.3143(9) 0.3686(9) 0.1401(6) 0.048(3) Uani 1 d . .
H2 H 0.3354 0.3218 0.1094 0.06(2) Uiso 1 calc R .
C3 C 0.2402(8) 0.3281(10) 0.1694(8) 0.058(4) Uani 1 d . .
H3A H 0.1939 0.3338 0.1348 0.06(2) Uiso 1 calc R .
H3B H 0.2272 0.3675 0.2075 0.06(2) Uiso 1 calc R .
C4 C 0.1824(9) 0.2144(14) 0.2507(10) 0.091(6) Uani 1 d . .
H4A H 0.2024 0.2492 0.2905 0.063(12) Uiso 1 calc R .
H4B H 0.1794 0.1496 0.2622 0.063(12) Uiso 1 calc R .
H4C H 0.1279 0.2363 0.2348 0.063(12) Uiso 1 calc R .
C5 C 0.2940(11) 0.4523(11) 0.0989(8) 0.071(5) Uani 1 d . .
H5A H 0.2623 0.4945 0.1246 0.063(12) Uiso 1 calc R .
H5B H 0.2618 0.4349 0.0575 0.063(12) Uiso 1 calc R .
H5C H 0.3446 0.4820 0.0876 0.063(12) Uiso 1 calc R .
C6 C 0.5295(9) 0.4374(12) 0.3538(8) 0.062(4) Uani 1 d . .
H6 H 0.5111 0.4734 0.3161 0.063(12) Uiso 1 calc R .
C7 C 0.5650(9) 0.4813(12) 0.4103(9) 0.066(5) Uani 1 d . .
H7 H 0.5701 0.5458 0.4109 0.063(12) Uiso 1 calc R .
C8 C 0.5928(10) 0.4308(14) 0.4653(10) 0.077(5) Uani 1 d . .
H8 H 0.6158 0.4597 0.5049 0.063(12) Uiso 1 calc R .
C9 C 0.5863(10) 0.3348(14) 0.4615(8) 0.072(5) Uani 1 d . .
H9 H 0.6057 0.2983 0.4986 0.063(12) Uiso 1 calc R .
C10 C 0.5507(8) 0.2928(10) 0.4020(7) 0.047(4) Uani 1 d . .
C11 C 0.5460(8) 0.1924(11) 0.3926(7) 0.047(3) Uani 1 d . .
C12 C 0.5829(9) 0.1326(12) 0.4407(8) 0.065(4) Uani 1 d . .
H12 H 0.6070 0.1547 0.4822 0.063(12) Uiso 1 calc R .
C13 C 0.5830(10) 0.0381(13) 0.4253(10) 0.079(5) Uani 1 d . .
H13 H 0.6084 -0.0042 0.4563 0.063(12) Uiso 1 calc R .
C14 C 0.5457(10) 0.0082(12) 0.3648(10) 0.075(5) Uani 1 d . .
H14 H 0.5448 -0.0548 0.3536 0.063(12) Uiso 1 calc R .
C15 C 0.5097(9) 0.0721(10) 0.3212(8) 0.058(4) Uani 1 d . .
H15 H 0.4859 0.0518 0.2790 0.063(12) Uiso 1 calc R .
C2,1 C 0.3151(8) -0.0105(7) 0.2284(4) 0.076(5) Uani 1 d G .
H2,1 H 0.3232 -0.0145 0.1820 0.091 Uiso 1 calc R .
C3,1 C 0.2928(10) -0.0894(5) 0.2639(6) 0.124(9) Uani 1 d G .
H3,1 H 0.2861 -0.1461 0.2412 0.149 Uiso 1 calc R .
C4,1 C 0.2806(9) -0.0835(7) 0.3334(6) 0.114(8) Uani 1 d G .
H4,1 H 0.2658 -0.1363 0.3571 0.137 Uiso 1 calc R .
C5,1 C 0.2907(8) 0.0012(8) 0.3673(4) 0.081(5) Uani 1 d G .
H5,1 H 0.2825 0.0052 0.4138 0.098 Uiso 1 calc R .
C6,1 C 0.3129(6) 0.0801(6) 0.3318(4) 0.059(4) Uani 1 d G .
H6,1 H 0.3196 0.1368 0.3545 0.071 Uiso 1 calc R .
C1,1 C 0.3251(6) 0.0742(5) 0.2623(4) 0.043(3) Uani 1 d G .
C2,2 C 0.3383(4) 0.1279(7) 0.0769(4) 0.050(4) Uani 1 d G .
H2,2 H 0.2806 0.1304 0.0779 0.060 Uiso 1 calc R .
C3,2 C 0.3736(6) 0.1070(7) 0.0161(3) 0.069(5) Uani 1 d G .
H3,2 H 0.3395 0.0955 -0.0236 0.083 Uiso 1 calc R .
C4,2 C 0.4598(6) 0.1033(7) 0.0146(4) 0.062(4) Uani 1 d G .
H4,2 H 0.4834 0.0893 -0.0261 0.074 Uiso 1 calc R .
C5,2 C 0.5106(4) 0.1204(7) 0.0739(5) 0.078(5) Uani 1 d G .
H5,2 H 0.5683 0.1179 0.0729 0.094 Uiso 1 calc R .
C6,2 C 0.4753(5) 0.1413(7) 0.1347(4) 0.053(4) Uani 1 d G .
H6,2 H 0.5094 0.1528 0.1744 0.063 Uiso 1 calc R .
C1,2 C 0.3892(5) 0.1451(6) 0.1362(3) 0.041(3) Uani 1 d G .
C2,3 C 0.5284(7) 0.5143(6) 0.1834(5) 0.071(5) Uani 1 d G .
H2,3 H 0.5138 0.5487 0.2209 0.085 Uiso 1 calc R .
C3,3 C 0.5940(6) 0.5433(7) 0.1464(6) 0.082(5) Uani 1 d G .
H3,3 H 0.6233 0.5972 0.1591 0.099 Uiso 1 calc R .
C4,3 C 0.6159(6) 0.4919(9) 0.0903(6) 0.088(6) Uani 1 d G .
H4,3 H 0.6598 0.5113 0.0655 0.105 Uiso 1 calc R .
C5,3 C 0.5721(7) 0.4113(8) 0.0713(5) 0.086(6) Uani 1 d G .
H5,3 H 0.5867 0.3769 0.0338 0.104 Uiso 1 calc R .
C6,3 C 0.5064(6) 0.3822(6) 0.1084(5) 0.064(4) Uani 1 d G .
H6,3 H 0.4771 0.3284 0.0957 0.077 Uiso 1 calc R .
C1,3 C 0.4846(5) 0.4337(6) 0.1644(4) 0.042(3) Uani 1 d G .
C2,4 C 0.3240(6) 0.4549(6) 0.3214(4) 0.049(4) Uani 1 d G .
H2,4 H 0.3284 0.3937 0.3367 0.059 Uiso 1 calc R .
C3,4 C 0.2848(6) 0.5212(8) 0.3595(4) 0.078(5) Uani 1 d G .
H3,4 H 0.2630 0.5043 0.4004 0.094 Uiso 1 calc R .
C4,4 C 0.2782(7) 0.6127(8) 0.3366(6) 0.096(7) Uani 1 d G .
H4,4 H 0.2520 0.6570 0.3621 0.115 Uiso 1 calc R .
C5,4 C 0.3108(8) 0.6379(5) 0.2755(6) 0.097(7) Uani 1 d G .
H5,4 H 0.3064 0.6992 0.2601 0.116 Uiso 1 calc R .
C6,4 C 0.3500(7) 0.5717(6) 0.2373(4) 0.066(4) Uani 1 d G .
H6,4 H 0.3719 0.5886 0.1964 0.079 Uiso 1 calc R .
C1,4 C 0.3566(6) 0.4802(5) 0.2602(4) 0.040(3) Uani 1 d G .
P3 P 0.3283(3) 0.2660(3) 0.49728(19) 0.0649(11) Uani 1 d . .
P4 P 0.1821(4) 0.2759(3) -0.0702(2) 0.0813(14) Uani 1 d . .
F1 F 0.2683(8) 0.2664(9) 0.4284(6) 0.120(4) Uiso 1 d . .
F2 F 0.3753(10) 0.2692(11) 0.5678(9) 0.164(6) Uiso 1 d . .
F3_a F 0.3952(14) 0.1979(16) 0.4702(11) 0.110(8) Uiso 0.56(2) d P 1
F4_a F 0.2784(19) 0.175(2) 0.5130(15) 0.134(11) Uiso 0.56(2) d P 1
F5_a F 0.3819(13) 0.3542(15) 0.4778(11) 0.106(8) Uiso 0.56(2) d P 1
F6_a F 0.2613(18) 0.330(2) 0.5244(15) 0.145(10) Uiso 0.56(2) d P 1
F3_b F 0.3010(17) 0.3781(19) 0.4947(14) 0.102(10) Uiso 0.44(2) d P 2
F4_b F 0.379(2) 0.270(2) 0.4328(18) 0.138(13) Uiso 0.44(2) d P 2
F5_b F 0.2461(14) 0.2659(19) 0.5409(12) 0.084(8) Uiso 0.44(2) d P 2
F6_b F 0.314(2) 0.158(2) 0.4971(17) 0.118(12) Uiso 0.44(2) d P 2
F8 F 0.1979(9) 0.1683(10) -0.0666(7) 0.140(5) Uiso 1 d . .
F10 F 0.1497(15) 0.3806(16) -0.0686(11) 0.212(9) Uiso 1 d . .
F11 F 0.0867(12) 0.2503(12) -0.0615(9) 0.184(7) Uiso 1 d . .
F7_a F 0.1898(9) 0.2738(11) 0.0088(8) 0.110(6) Uiso 0.761(18) d P 1
F9_a F 0.1401(13) 0.2728(13) -0.1470(10) 0.140(7) Uiso 0.761(18) d P 1
F12_a F 0.264(2) 0.302(2) -0.0881(18) 0.227(13) Uiso 0.761(18) d P 1
F7_b F 0.285(2) 0.296(2) -0.0306(18) 0.054(11) Uiso 0.239(18) d P 2
F9_b F 0.225(3) 0.271(3) -0.140(2) 0.086(14) Uiso 0.239(18) d P 2
F12_b F 0.202(3) 0.385(3) -0.076(2) 0.081(14) Uiso 0.239(18) d P 2
C16 C 0.0764(14) 0.6920(16) 0.1799(10) 0.122(7) Uani 1 d . .
Cl1 Cl 0.0755(4) 0.7410(4) 0.2612(4) 0.142(2) Uani 1 d . .
Cl2 Cl 0.0854(4) 0.5740(4) 0.1822(3) 0.146(2) Uani 1 d . .

loop_
 _atom_site_aniso_label
 _atom_site_aniso_U_11
 _atom_site_aniso_U_22
 _atom_site_aniso_U_33
 _atom_site_aniso_U_23
 _atom_site_aniso_U_13
 _atom_site_aniso_U_12
Pd1 0.0380(5) 0.0327(5) 0.0364(5) -0.0029(5) 0.0042(4) -0.0005(5)
P1 0.0411(19) 0.0349(19) 0.0377(19) -0.0027(15) 0.0038(15) -0.0019(15)
P2 0.046(2) 0.0329(18) 0.0380(19) 0.0008(14) 0.0069(15) 0.0021(15)
N1 0.049(7) 0.044(7) 0.044(7) -0.007(6) 0.002(5) -0.008(6)
N2 0.043(6) 0.037(7) 0.049(7) 0.003(5) 0.009(5) 0.005(5)
C1 0.050(8) 0.067(9) 0.048(8) 0.004(8) -0.001(6) 0.010(8)
C2 0.067(9) 0.046(8) 0.031(7) 0.006(6) -0.003(6) 0.002(7)
C3 0.038(8) 0.061(10) 0.075(11) 0.001(8) 0.003(7) 0.006(7)
C4 0.042(9) 0.111(16) 0.127(16) -0.001(12) 0.040(10) 0.009(9)
C5 0.088(12) 0.070(11) 0.051(9) 0.000(8) -0.016(8) 0.005(9)
C6 0.048(9) 0.068(11) 0.068(11) -0.001(9) -0.003(8) 0.004(8)
C7 0.043(9) 0.071(11) 0.083(12) -0.027(10) -0.007(8) -0.008(8)
C8 0.054(10) 0.094(15) 0.080(13) -0.032(11) -0.016(9) -0.004(10)
C9 0.063(11) 0.103(15) 0.049(10) -0.016(10) -0.003(8) 0.012(10)
C10 0.034(7) 0.065(11) 0.041(8) -0.009(7) 0.006(6) -0.004(6)
C11 0.027(7) 0.072(10) 0.042(8) 0.012(7) 0.005(6) -0.005(6)
C12 0.051(9) 0.078(12) 0.064(11) 0.001(9) -0.012(8) 0.021(8)
C13 0.054(10) 0.084(14) 0.096(14) 0.036(11) -0.005(10) 0.025(9)
C14 0.072(12) 0.050(10) 0.103(15) 0.009(10) -0.001(11) 0.002(9)
C15 0.051(9) 0.049(9) 0.072(11) 0.016(8) 0.001(8) 0.014(7)
C2,1 0.140(17) 0.043(10) 0.048(9) -0.002(7) 0.021(10) -0.017(9)
C3,1 0.22(3) 0.034(10) 0.116(18) 0.006(11) 0.026(17) -0.038(13)
C4,1 0.18(2) 0.080(15) 0.083(15) 0.008(12) 0.032(15) -0.057(15)
C5,1 0.111(15) 0.078(12) 0.059(11) 0.006(9) 0.032(10) -0.026(11)
C6,1 0.063(10) 0..066(10) 0.050(9) -0.003(8) 0.009(7) 0.004(8)
C1,1 0.047(8) 0.036(7) 0.048(8) -0.005(6) 0.016(6) -0.006(6)
C2,2 0.051(8) 0.060(9) 0.040(8) -0.018(7) 0.007(7) -0.012(7)
C3,2 0.079(12) 0.093(13) 0.035(8) -0.017(8) -0.005(8) -0.016(10)
C4,2 0.091(12) 0.054(9) 0.042(9) -0.007(7) 0.019(8) 0.011(9)
C5,2 0.073(11) 0.098(14) 0.066(12) -0.018(10) 0.020(9) 0.013(10)
C6,2 0.055(9) 0.068(10) 0.036(8) -0.006(7) 0.011(6) 0.009(7)
C1,2 0.057(8) 0.025(6) 0.043(8) 0.000(5) 0.012(6) -0.003(6)
C2,3 0.088(12) 0.053(10) 0.073(11) -0.001(8) 0.027(9) -0.012(9)
C3,3 0.078(12) 0.068(12) 0.105(15) -0.001(10) 0.035(11) -0.031(10)
C4,3 0.069(12) 0.089(14) 0.108(16) 0.027(12) 0.029(11) 0.009(11)
C5,3 0.096(14) 0.083(13) 0.085(13) -0.023(11) 0.035(11) 0.019(11)
C6,3 0.076(11) 0.054(9) 0.067(10) -0.021(8) 0.035(9) -0.008(8)
C1,3 0.044(7) 0.034(7) 0.048(8) 0.002(6) 0.009(6) -0.006(6)
C2,4 0.045(8) 0.068(10) 0.036(8) -0.002(7) 0.006(6) 0.006(7)
C3,4 0.071(12) 0.106(15) 0.059(11) -0.011(10) 0.016(9) 0.006(11)
C4,4 0.111(15) 0.114(17) 0.065(12) -0.034(11) 0.023(11) 0.054(13)
C5,4 0.146(18) 0.064(12) 0.085(14) -0.011(10) 0.033(13) 0.046(12)
C6,4 0.105(13) 0.043(9) 0.051(9) -0.007(7) 0.010(9) 0.008(9)
C1,4 0.049(8) 0.039(7) 0.032(7) -0.008(6) 0.004(6) -0.009(6)
P3 0.076(3) 0.076(3) 0.045(2) -0.010(2) 0.019(2) -0.010(2)
P4 0.124(4) 0.053(3) 0.070(3) 0.006(2) 0.031(3) 0.002(3)
C16 0.172(18) 0.116(17) 0.077(14) -0.002(12) 0.003(12) -0.017(14)
Cl1 0.172(4) 0.120(5) 0.133(5) 0.002(4) -0.004(4) 0.008(4)
Cl2 0.200(5) 0.114(5) 0.127(5) -0.003(4) 0.039(4) -0.033(4)

_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
Pd1 N1 2.122(11) . ?
Pd1 N2 2.136(10) . ?
Pd1 P1 2.267(3) . ?
Pd1 P2 2.286(3) . ?
P1 C1,1 1.798(7) . ?
P1 C1,2 1.819(7) . ?
P1 C1 1.866(14) . ?
P2 C1,4 1.792(7) . ?
P2 C1,3 1.816(8) . ?
P2 C2 1.842(13) . ?
N1 C6 1.337(17) . ?
N1 C10 1.334(17) . ?
N2 C11 1.315(16) . ?
N2 C15 1.319(17) . ?
C1 C4 1.50(2) . ?
C1 C3 1.533(19) . ?
C2 C5 1.470(18) . ?
C2 C3 1.480(18) . ?
C6 C7 1.36(2) . ?
C7 C8 1.34(2) . ?
C8 C9 1.38(2) . ?
C9 C10 1.395(19) . ?
C10 C11 1.45(2) . ?
C11 C12 1.375(19) . ?
C12 C13 1.39(2) . ?
C13 C14 1.36(2) . ?
C14 C15 1.35(2) . ?
C2,1 C3,1 1.3900 . ?
C2,1 C1,1 1.3900 . ?
C3,1 C4,1 1.3900 . ?
C4,1 C5,1 1.3900 . ?
C5,1 C6,1 1.3900 . ?
C6,1 C1,1 1.3900 . ?
C2,2 C3,2 1.3900 . ?
C2,2 C1,2 1.3900 . ?
C3,2 C4,2 1.3900 . ?
C4,2 C5,2 1.3900 . ?
C5,2 C6,2 1.3900 . ?
C6,2 C1,2 1.3900 . ?
C2,3 C3,3 1.3900 . ?
C2,3 C1,3 1.3900 . ?
C3,3 C4,3 1.3900 . ?
C4,3 C5,3 1.3900 . ?
C5,3 C6,3 1.3900 . ?
C6,3 C1,3 1.3900 . ?
C2,4 C3,4 1.3900 . ?
C2,4 C1,4 1.3900 . ?
C3,4 C4,4 1.3900 . ?
C4,4 C5,4 1.3900 . ?
C5,4 C6,4 1.3900 . ?
C6,4 C1,4 1.3900 . ?
P3 F2 1.523(17) . ?
P3 F6_a 1.54(3) . ?
P3 F4_b 1.55(3) . ?
P3 F6_b 1.57(3) . ?
P3 F4_a 1.58(3) . ?
P3 F3_a 1.58(2) . ?
P3 F5_a 1.60(2) . ?
P3 F1 1.596(13) . ?
P3 F5_b 1.63(2) . ?
P3 F3_b 1.67(3) . ?
P4 F12_a 1.44(3) . ?
P4 F7_a 1.542(15) . ?
P4 F9_b 1.57(4) . ?
P4 F8 1.567(14) . ?
P4 F10 1.59(2) . ?
P4 F11 1.60(2) . ?
P4 F9_a 1.600(19) . ?
P4 F12_b 1.61(4) . ?
P4 F7_b 1.79(3) . ?
F10 F12_b 0.86(5) . ?
C16 Cl2 1.70(2) . ?
C16 Cl1 1.74(2) . ?

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 77.1(5) . . ?
N1 Pd1 P1 169.1(3) . . ?
N2 Pd1 P1 98.6(3) . . ?
N1 Pd1 P2 98.2(3) . . ?
N2 Pd1 P2 169.7(3) . . ?
P1 Pd1 P2 87.60(13) . . ?
C1,1 P1 C1,2 108.1(4) . . ?
C1,1 P1 C1 102.1(6) . . ?
C1,2 P1 C1 107.5(5) . . ?
C1,1 P1 Pd1 111.5(3) . . ?
C1,2 P1 Pd1 108.7(3) . . ?
C1 P1 Pd1 118.4(5) . . ?
C1,4 P2 C1,3 110.5(4) . . ?
C1,4 P2 C2 105.0(5) . . ?
C1,3 P2 C2 104.9(5) . . ?
C1,4 P2 Pd1 109.5(3) . . ?
C1,3 P2 Pd1 108.4(3) . . ?
C2 P2 Pd1 118.4(4) . . ?
C6 N1 C10 118.5(12) . . ?
C6 N1 Pd1 127.8(10) . . ?
C10 N1 Pd1 112.9(9) . . ?
C11 N2 C15 119.0(12) . . ?
C11 N2 Pd1 113.3(9) . . ?
C15 N2 Pd1 127.6(10) . . ?
C4 C1 C3 111.4(13) . . ?
C4 C1 P1 114.1(10) . . ?
C3 C1 P1 114.2(10) . . ?
C5 C2 C3 112.4(13) . . ?
C5 C2 P2 112.2(10) . . ?
C3 C2 P2 110.2(9) . . ?
C2 C3 C1 120.8(12) . . ?
N1 C6 C7 123.3(16) . . ?
C8 C7 C6 119.6(17) . . ?
C7 C8 C9 118.4(16) . . ?
C8 C9 C10 120.0(17) . . ?
N1 C10 C9 120.1(14) . . ?
N1 C10 C11 116.6(12) . . ?
C9 C10 C11 123.3(14) . . ?
N2 C11 C12 121.7(15) . . ?
N2 C11 C10 117.2(12) . . ?
C12 C11 C10 121.1(14) . . ?
C11 C12 C13 118.0(15) . . ?
C14 C13 C12 119.4(15) . . ?
C13 C14 C15 118.4(16) . . ?
N2 C15 C14 123.2(16) . . ?
C3,1 C2,1 C1,1 120.0 . . ?
C4,1 C3,1 C2,1 120.0 . . ?
C3,1 C4,1 C5,1 120.0 . . ?
C6,1 C5,1 C4,1 120.0 . . ?
C5,1 C6,1 C1,1 120.0 . . ?
C6,1 C1,1 C2,1 120.0 . . ?
C6,1 C1,1 P1 119.1(5) . . ?
C2,1 C1,1 P1 120.8(5) . . ?
C3,2 C2,2 C1,2 120.0 . . ?
C2,2 C3,2 C4,2 120.0 . . ?
C5,2 C4,2 C3,2 120.0 . . ?
C6,2 C5,2 C4,2 120.0 . . ?
C5,2 C6,2 C1,2 120.0 . . ?
C6,2 C1,2 C2,2 120.0 . . ?
C6,2 C1,2 P1 117.7(5) . . ?
C2,2 C1,2 P1 122.3(5) . . ?
C3,3 C2,3 C1,3 120.0 . . ?
C4,3 C3,3 C2,3 120.0 . . ?
C5,3 C4,3 C3,3 120.0 . . ?
C4,3 C5,3 C6,3 120.0 . . ?
C1,3 C6,3 C5,3 120.0 . . ?
C6,3 C1,3 C2,3 120.0 . . ?
C6,3 C1,3 P2 116.4(5) . . ?
C2,3 C1,3 P2 123.6(5) . . ?
C3,4 C2,4 C1,4 120.0 . . ?
C4,4 C3,4 C2,4 120.0 . . ?
C3,4 C4,4 C5,4 120.0 . . ?
C4,4 C5,4 C6,4 120.0 . . ?
C1,4 C6,4 C5,4 120.0 . . ?
C6,4 C1,4 C2,4 120.0 . . ?
C6,4 C1,4 P2 121.3(5) . . ?
C2,4 C1,4 P2 118.4(5) . . ?
F2 P3 F6_a 88.9(12) . . ?
F2 P3 F4_b 118.7(14) . . ?
F2 P3 F6_b 95.4(13) . . ?
F4_b P3 F6_b 96.6(18) . . ?
F2 P3 F4_a 94.2(12) . . ?
F6_a P3 F4_a 92.8(17) . . ?
F2 P3 F3_a 91.1(10) . . ?
F6_a P3 F3_a 178.3(16) . . ?
F4_a P3 F3_a 85.6(14) . . ?
F2 P3 F5_a 87.3(10) . . ?
F6_a P3 F5_a 90.7(15) . . ?
F4_a P3 F5_a 176.3(14) . . ?
F3_a P3 F5_a 91.0(11) . . ?
F2 P3 F1 172.4(8) . . ?
F6_a P3 F1 84.0(11) . . ?
F4_b P3 F1 68.6(13) . . ?
F6_b P3 F1 85.6(13) . . ?
F4_a P3 F1 83.4(11) . . ?
F3_a P3 F1 95.9(9) . . ?
F5_a P3 F1 95.6(9) . . ?
F2 P3 F5_b 83.8(10) . . ?
F4_b P3 F5_b 157.4(15) . . ?
F6_b P3 F5_b 82.9(16) . . ?
F1 P3 F5_b 88.8(9) . . ?
F2 P3 F3_b 96.3(11) . . ?
F4_b P3 F3_b 95.6(16) . . ?
F6_b P3 F3_b 156.5(17) . . ?
F1 P3 F3_b 80.2(10) . . ?
F5_b P3 F3_b 78.1(13) . . ?
F12_a P4 F7_a 104.1(16) . . ?
F12_a P4 F8 96.6(14) . . ?
F7_a P4 F8 86.3(8) . . ?
F9_b P4 F8 85.1(16) . . ?
F12_a P4 F10 94.0(15) . . ?
F7_a P4 F10 90.0(10) . . ?
F9_b P4 F10 103.1(18) . . ?
F8 P4 F10 169.3(11) . . ?
F12_a P4 F11 171.8(16) . . ?
F7_a P4 F11 83..8(9) . . ?
F9_b P4 F11 124.7(18) . . ?
F8 P4 F11 85.5(8) . . ?
F10 P4 F11 84.1(11) . . ?
F12_a P4 F9_a 96.2(15) . . ?
F7_a P4 F9_a 159.5(10) . . ?
F8 P4 F9_a 94.1(9) . . ?
F10 P4 F9_a 86.0(10) . . ?
F11 P4 F9_a 75.7(10) . . ?
F9_b P4 F12_b 83(2) . . ?
F8 P4 F12_b 159.2(19) . . ?
F10 P4 F12_b 31.2(16) . . ?
F11 P4 F12_b 115.3(19) . . ?
F9_b P4 F7_b 86.0(19) . . ?
F8 P4 F7_b 89.7(11) . . ?
F10 P4 F7_b 97.7(13) . . ?
F11 P4 F7_b 148.2(13) . . ?
F12_b P4 F7_b 72(2) . . ?
F12_b F10 P4 75(4) . . ?
F10 F12_b P4 73(4) . . ?
Cl2 C16 Cl1 112.6(12) . . ?

_refine_diff_density_max    1.133
_refine_diff_density_min   -0.842
_refine_diff_density_rms    0.141