#------------------------------------------------------------------------------
#$Date: 2017-04-22 05:09:35 +0300 (Sat, 22 Apr 2017) $
#$Revision: 195681 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/27/7042748.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_7042748
loop_
_publ_author_name
'Kashid, Vitthal S.'
'Radhakrishna, Latchupatula'
'Balakrishna, Maravanji Shivaramaiah'
_publ_section_title
;
 First examples of tri- and tetraphosphametacyclophanes: synthesis and
 isolation of an unusual hexapalladium complex containing pincer units
 with Pd---P covalent bonds
;
_journal_name_full               'Dalton Trans.'
_journal_paper_doi               10.1039/C7DT00737J
_journal_year                    2017
_chemical_formula_moiety         'C44 H36 Cl6 N2 O4 P4 Pd6'
_chemical_formula_sum            'C44 H36 Cl6 N2 O4 P4 Pd6'
_chemical_formula_weight         1631.73
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2017-02-11 deposited with the CCDC.
2017-04-20 downloaded from the CCDC.
;
_cell_angle_alpha                102.789(2)
_cell_angle_beta                 95.8839(19)
_cell_angle_gamma                113.851(2)
_cell_formula_units_Z            1
_cell_length_a                   10.0974(2)
_cell_length_b                   10.1677(3)
_cell_length_c                   13.9117(3)
_cell_measurement_reflns_used    18735
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      31.1890
_cell_measurement_theta_min      2.2500
_cell_volume                     1244.02(6)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      150(2)
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Rigaku saturn 724'
_diffrn_measurement_method       ω
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0426
_diffrn_reflns_av_unetI/netI     0.0271
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            22657
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        24.998
_diffrn_reflns_theta_max         24.998
_diffrn_reflns_theta_min         2.288
_exptl_absorpt_coefficient_mu    2.618
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.48285
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   'NUMABS RIGAKU 1999'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    2.178
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             784
_exptl_crystal_size_max          0.160
_exptl_crystal_size_mid          0.064
_exptl_crystal_size_min          0.03
_refine_diff_density_max         0.839
_refine_diff_density_min         -0.526
_refine_diff_density_rms         0.122
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.061
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     326
_refine_ls_number_reflns         4353
_refine_ls_number_restraints     36
_refine_ls_restrained_S_all      1.060
_refine_ls_R_factor_all          0.0284
_refine_ls_R_factor_gt           0.0252
_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)+(0.0318P)²+2.2641P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0626
_refine_ls_wR_factor_ref         0.0646
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4043
_reflns_number_total             4353
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c7dt00737j2.cif
_cod_data_source_block           MSB-VSK-294
_cod_original_cell_volume        1244.01(6)
_cod_database_code               7042748
_shelx_shelxl_version_number     2014/7
_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.
;
loop_
_space_group_symop_operation_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_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
Pd2 Pd 0.53200(3) 0.26381(3) 0.27805(2) 0.01663(8) Uani 1 1 d . . . . .
Pd1 Pd 0.32093(3) 0.43290(3) 0.46103(2) 0.01666(8) Uani 1 1 d . . . . .
Pd3 Pd 0.46494(3) -0.08613(3) 0.11274(2) 0.02406(9) Uani 1 1 d . . . . .
Cl1 Cl 0.28272(11) 0.19993(10) 0.47405(7) 0.0263(2) Uani 1 1 d . . . . .
Cl3 Cl 0.66388(10) 0.11253(10) 0.24302(8) 0.0287(2) Uani 1 1 d . . . . .
P2 P 0.26803(10) 0.53516(10) 0.61218(7) 0.01756(19) Uani 1 1 d . . . . .
P1 P 0.39585(10) 0.38949(10) 0.31266(7) 0.01821(19) Uani 1 1 d . . . . .
Cl2 Cl 0.32500(10) 0.04853(10) 0.16193(8) 0.0313(2) Uani 1 1 d . . . . .
O1 O 0.5669(3) 0.6357(3) 0.2562(2) 0.0283(6) Uani 1 1 d . . . . .
O2 O 0.0746(3) 0.6557(3) 0.5706(2) 0.0281(6) Uani 1 1 d . . . . .
N1 N 0.3358(3) 0.6272(3) 0.4315(2) 0.0173(6) Uani 1 1 d . . . . .
C5 C 0.2665(4) 0.7028(4) 0.4785(3) 0.0199(7) Uani 1 1 d . . . . .
C4 C 0.2731(4) 0.8331(4) 0.4609(3) 0.0254(8) Uani 1 1 d . . . . .
H4 H 0.2215 0.8811 0.4929 0.031 Uiso 1 1 calc R U . . .
C7 C 0.1362(4) 0.4357(4) 0.6805(3) 0.0221(8) Uani 1 1 d . . . . .
C8 C 0.0750(4) 0.5103(4) 0.7447(3) 0.0282(9) Uani 1 1 d . . . . .
H8 H 0.0992 0.6108 0.7511 0.034 Uiso 1 1 calc R U . . .
C2 C 0.4284(4) 0.8139(4) 0.3463(3) 0.0253(8) Uani 1 1 d . . . . .
H2 H 0.4854 0.8508 0.3014 0.030 Uiso 1 1 calc R U . . .
C9 C -0.0220(4) 0.4344(5) 0.7987(3) 0.0312(9) Uani 1 1 d . . . . .
H9 H -0.0646 0.4834 0.8403 0.037 Uiso 1 1 calc R U . . .
C19 C 0.0976(4) 0.2224(5) 0.2154(3) 0.0322(9) Uani 1 1 d . . . . .
H19 H 0.0817 0.2032 0.2766 0.039 Uiso 1 1 calc R U . . .
C10 C -0.0551(5) 0.2880(5) 0.7912(3) 0.0351(10) Uani 1 1 d . . . . .
H10 H -0.1186 0.2386 0.8290 0.042 Uiso 1 1 calc R U . . .
C3 C 0.3574(5) 0.8917(4) 0.3951(3) 0.0292(9) Uani 1 1 d . . . . .
H3 H 0.3664 0.9815 0.3839 0.035 Uiso 1 1 calc R U . . .
C16 C 0.1406(5) 0.2822(5) 0.0325(3) 0.0393(11) Uani 1 1 d . . . . .
H16 H 0.1538 0.3046 -0.0281 0.047 Uiso 1 1 calc R U . . .
C11 C 0.0043(5) 0.2122(5) 0.7280(3) 0.0360(10) Uani 1 1 d . . . . .
H11 H -0.0199 0.1120 0.7229 0.043 Uiso 1 1 calc R U . . .
C12 C 0.1004(4) 0.2861(4) 0.6722(3) 0.0278(9) Uani 1 1 d . . . . .
H12 H 0.1406 0.2356 0.6295 0.033 Uiso 1 1 calc R U . . .
C1 C 0.4140(4) 0.6820(4) 0.3646(3) 0.0195(7) Uani 1 1 d . . . . .
C13 C 0.4786(4) 0.5883(4) 0.3069(3) 0.0207(8) Uani 1 1 d . . . . .
C15 C 0.2596(5) 0.3466(5) 0.1152(3) 0.0310(9) Uani 1 1 d . . . . .
H15 H 0.3536 0.4092 0.1092 0.037 Uiso 1 1 calc R U . . .
C6 C 0.1825(4) 0.6385(4) 0.5536(3) 0.0212(8) Uani 1 1 d . . . . .
C20 C 0.5402(17) -0.2406(17) 0.0550(11) 0.050(5) Uani 0.5 1 d . U P A 2
H20A H 0.6371 -0.2001 0.0385 0.060 Uiso 0.5 1 calc R U P A 2
H20B H 0.5270 -0.3169 0.0893 0.060 Uiso 0.5 1 calc R U P A 2
C18 C -0.0190(5) 0.1566(5) 0.1310(4) 0.0420(11) Uani 1 1 d . . . . .
H18 H -0.1133 0.0923 0.1355 0.050 Uiso 1 1 calc R U . . .
C14 C 0.2373(4) 0.3170(4) 0.2068(3) 0.0233(8) Uani 1 1 d . . . . .
C17 C 0.0056(5) 0.1866(6) 0.0414(4) 0.0483(13) Uani 1 1 d . . . . .
H17 H -0.0725 0.1401 -0.0148 0.058 Uiso 1 1 calc R U . . .
C22 C 0.3299(13) -0.2694(11) -0.0125(8) 0.035(3) Uani 0.499(14) 1 d . U P A 2
H22A H 0.2565 -0.3549 0.0025 0.042 Uiso 0.499(14) 1 calc R U P A 2
H22B H 0.2897 -0.2449 -0.0687 0.042 Uiso 0.499(14) 1 calc R U P A 2
C21 C 0.4320(10) -0.2691(10) -0.0132(8) 0.037(3) Uani 0.499(14) 1 d . U P A 2
H21 H 0.4707 -0.2282 -0.0673 0.044 Uiso 0.499(14) 1 calc R U P A 2
C22A C 0.2980(13) -0.2958(13) 0.0155(10) 0.045(3) Uani 0.501(14) 1 d . U P A 1
H22C H 0.2148 -0.3491 0.0433 0.054 Uiso 0.501(14) 1 calc R U P A 1
H22D H 0.2695 -0.2993 -0.0541 0.054 Uiso 0.501(14) 1 calc R U P A 1
C21A C 0.4181(10) -0.3104(10) 0.0392(7) 0.035(3) Uani 0.501(14) 1 d . U P A 1
H21A H 0.4013 -0.3627 0.0914 0.042 Uiso 0.501(14) 1 calc R U P A 1
C20A C 0.5789(11) -0.2163(11) 0.0608(7) 0.015(2) Uani 0.5 1 d . U P A 1
H20C H 0.6231 -0.1989 0.0033 0.018 Uiso 0.5 1 calc R U P A 1
H20D H 0.6392 -0.2316 0.1120 0.018 Uiso 0.5 1 calc R U P A 1
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'
Cl Cl 0.1484 0.1585 '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'
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'
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
P1 Pd2 P2 88.55(3) . 2_666
P1 Pd2 Cl2 92.89(3) . .
P2 Pd2 Cl2 178.56(3) 2_666 .
P1 Pd2 Cl3 175.69(3) . .
P2 Pd2 Cl3 94.27(3) 2_666 .
Cl2 Pd2 Cl3 84.29(3) . .
N1 Pd1 P1 84.63(8) . .
N1 Pd1 Cl1 172.49(8) . .
P1 Pd1 Cl1 91.36(3) . .
N1 Pd1 P2 82.94(8) . .
P1 Pd1 P2 166.74(3) . .
Cl1 Pd1 P2 101.49(3) . .
C20 Pd3 C22 61.0(5) . .
C21A Pd3 C22A 35.6(4) . .
C21A Pd3 C20A 40.4(3) . .
C22A Pd3 C20A 74.2(4) . .
C20 Pd3 C21 34.9(5) . .
C22 Pd3 C21 28.1(4) . .
C20 Pd3 Cl2 167.3(4) . .
C22 Pd3 Cl2 107.2(3) . .
C21A Pd3 Cl2 136.5(2) . .
C22A Pd3 Cl2 102.4(3) . .
C20A Pd3 Cl2 176.4(3) . .
C21 Pd3 Cl2 134.4(2) . .
C20 Pd3 Cl3 106.9(4) . .
C22 Pd3 Cl3 167.0(3) . .
C21A Pd3 Cl3 133.7(3) . .
C22A Pd3 Cl3 166.6(3) . .
C20A Pd3 Cl3 98.4(3) . .
C21 Pd3 Cl3 138.9(2) . .
Cl2 Pd3 Cl3 85.23(3) . .
Pd3 Cl3 Pd2 94.61(3) . .
C7 P2 C6 105.50(16) . .
C7 P2 Pd2 110.48(12) . 2_666
C6 P2 Pd2 98.99(11) . 2_666
C7 P2 Pd1 127.50(13) . .
C6 P2 Pd1 93.55(12) . .
Pd2 P2 Pd1 114.15(4) 2_666 .
C14 P1 C13 96.57(16) . .
C14 P1 Pd2 108.93(12) . .
C13 P1 Pd2 115.97(12) . .
C14 P1 Pd1 109.38(12) . .
C13 P1 Pd1 97.20(12) . .
Pd2 P1 Pd1 124.88(4) . .
Pd3 Cl2 Pd2 95.08(3) . .
C5 N1 C1 118.3(3) . .
C5 N1 Pd1 120.4(2) . .
C1 N1 Pd1 121.3(2) . .
N1 C5 C4 122.4(3) . .
N1 C5 C6 116.3(3) . .
C4 C5 C6 121.3(3) . .
C5 C4 C3 119.2(3) . .
C5 C4 H4 120.4 . .
C3 C4 H4 120.4 . .
C12 C7 C8 119.7(3) . .
C12 C7 P2 119.9(3) . .
C8 C7 P2 120.4(3) . .
C9 C8 C7 119.8(4) . .
C9 C8 H8 120.1 . .
C7 C8 H8 120.1 . .
C1 C2 C3 119.6(3) . .
C1 C2 H2 120.2 . .
C3 C2 H2 120.2 . .
C10 C9 C8 120.2(4) . .
C10 C9 H9 119.9 . .
C8 C9 H9 119.9 . .
C14 C19 C18 119.1(4) . .
C14 C19 H19 120.5 . .
C18 C19 H19 120.5 . .
C9 C10 C11 120.8(4) . .
C9 C10 H10 119.6 . .
C11 C10 H10 119.6 . .
C4 C3 C2 118.6(3) . .
C4 C3 H3 120.7 . .
C2 C3 H3 120.7 . .
C17 C16 C15 119.3(4) . .
C17 C16 H16 120.3 . .
C15 C16 H16 120.3 . .
C10 C11 C12 119.8(4) . .
C10 C11 H11 120.1 . .
C12 C11 H11 120.1 . .
C7 C12 C11 119.7(4) . .
C7 C12 H12 120.1 . .
C11 C12 H12 120.1 . .
N1 C1 C2 121.9(3) . .
N1 C1 C13 117.0(3) . .
C2 C1 C13 121.0(3) . .
O1 C13 C1 122.1(3) . .
O1 C13 P1 124.4(3) . .
C1 C13 P1 113.3(2) . .
C16 C15 C14 119.8(4) . .
C16 C15 H15 120.1 . .
C14 C15 H15 120.1 . .
O2 C6 C5 121.7(3) . .
O2 C6 P2 127.2(3) . .
C5 C6 P2 111.1(2) . .
C21 C20 Pd3 76.2(8) . .
C21 C20 H20A 115.8 . .
Pd3 C20 H20A 115.8 . .
C21 C20 H20B 115.8 . .
Pd3 C20 H20B 115.8 . .
H20A C20 H20B 112.8 . .
C17 C18 C19 119.9(4) . .
C17 C18 H18 120.0 . .
C19 C18 H18 120.0 . .
C19 C14 C15 120.0(4) . .
C19 C14 P1 119.8(3) . .
C15 C14 P1 119.9(3) . .
C16 C17 C18 121.7(4) . .
C16 C17 H17 119.1 . .
C18 C17 H17 119.1 . .
C21 C22 Pd3 78.3(8) . .
C21 C22 H22A 115.5 . .
Pd3 C22 H22A 115.5 . .
C21 C22 H22B 115.5 . .
Pd3 C22 H22B 115.5 . .
H22A C22 H22B 112.5 . .
C22 C21 C20 133.7(13) . .
C22 C21 Pd3 73.5(7) . .
C20 C21 Pd3 68.9(8) . .
C22 C21 H21 108.4 . .
C20 C21 H21 108.4 . .
Pd3 C21 H21 108.4 . .
C21A C22A Pd3 71.2(6) . .
C21A C22A H22C 116.5 . .
Pd3 C22A H22C 116.5 . .
C21A C22A H22D 116.5 . .
Pd3 C22A H22D 116.5 . .
H22C C22A H22D 113.5 . .
C22A C21A C20A 137.3(9) . .
C22A C21A Pd3 73.2(6) . .
C20A C21A Pd3 70.7(5) . .
C22A C21A H21A 105.6 . .
C20A C21A H21A 105.6 . .
Pd3 C21A H21A 105.6 . .
C21A C20A Pd3 68.8(5) . .
C21A C20A H20C 116.8 . .
Pd3 C20A H20C 116.8 . .
C21A C20A H20D 116.8 . .
Pd3 C20A H20D 116.8 . .
H20C C20A H20D 113.8 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pd2 P1 2.2448(9) .
Pd2 P2 2.2881(9) 2_666
Pd2 Cl2 2.4108(10) .
Pd2 Cl3 2.4154(9) .
Pd1 N1 2.056(3) .
Pd1 P1 2.2835(9) .
Pd1 Cl1 2.2930(9) .
Pd1 P2 2.3451(9) .
Pd3 C20 2.055(15) .
Pd3 C22 2.095(10) .
Pd3 C21A 2.113(9) .
Pd3 C22A 2.137(11) .
Pd3 C20A 2.139(9) .
Pd3 C21 2.139(9) .
Pd3 Cl2 2.3849(10) .
Pd3 Cl3 2.3983(10) .
P2 C7 1.815(4) .
P2 C6 1.866(4) .
P2 Pd2 2.2881(9) 2_666
P1 C14 1.832(4) .
P1 C13 1.873(4) .
O1 C13 1.207(4) .
O2 C6 1.209(4) .
N1 C5 1.348(5) .
N1 C1 1.350(5) .
C5 C4 1.376(5) .
C5 C6 1.508(5) .
C4 C3 1.381(6) .
C4 H4 0.9300 .
C7 C12 1.388(5) .
C7 C8 1.395(5) .
C8 C9 1.384(5) .
C8 H8 0.9300 .
C2 C1 1.374(5) .
C2 C3 1.386(6) .
C2 H2 0.9300 .
C9 C10 1.364(6) .
C9 H9 0.9300 .
C19 C14 1.385(6) .
C19 C18 1.394(6) .
C19 H19 0.9300 .
C10 C11 1.381(6) .
C10 H10 0.9300 .
C3 H3 0.9300 .
C16 C17 1.355(7) .
C16 C15 1.393(6) .
C16 H16 0.9300 .
C11 C12 1.390(6) .
C11 H11 0.9300 .
C12 H12 0.9300 .
C1 C13 1.501(5) .
C15 C14 1.393(5) .
C15 H15 0.9300 .
C20 C21 1.260(17) .
C20 H20A 0.9700 .
C20 H20B 0.9700 .
C18 C17 1.371(7) .
C18 H18 0.9300 .
C17 H17 0.9300 .
C22 C21 1.030(13) .
C22 H22A 0.9700 .
C22 H22B 0.9700 .
C21 H21 0.9800 .
C22A C21A 1.299(14) .
C22A H22C 0.9700 .
C22A H22D 0.9700 .
C21A C20A 1.469(13) .
C21A H21A 0.9800 .
C20A H20C 0.9700 .
C20A H20D 0.9700 .
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
C1 N1 C5 C4 -0.2(5) .
Pd1 N1 C5 C4 -179.9(3) .
C1 N1 C5 C6 -179.1(3) .
Pd1 N1 C5 C6 1.2(4) .
N1 C5 C4 C3 -2.1(6) .
C6 C5 C4 C3 176.8(3) .
C6 P2 C7 C12 134.4(3) .
Pd2 P2 C7 C12 -119.6(3) 2_666
Pd1 P2 C7 C12 27.3(4) .
C6 P2 C7 C8 -48.3(3) .
Pd2 P2 C7 C8 57.8(3) 2_666
Pd1 P2 C7 C8 -155.3(3) .
C12 C7 C8 C9 -0.6(6) .
P2 C7 C8 C9 -178.0(3) .
C7 C8 C9 C10 1.5(6) .
C8 C9 C10 C11 -1.5(6) .
C5 C4 C3 C2 2.3(6) .
C1 C2 C3 C4 -0.3(6) .
C9 C10 C11 C12 0.7(7) .
C8 C7 C12 C11 -0.1(6) .
P2 C7 C12 C11 177.3(3) .
C10 C11 C12 C7 0.1(6) .
C5 N1 C1 C2 2.2(5) .
Pd1 N1 C1 C2 -178.1(3) .
C5 N1 C1 C13 -174.8(3) .
Pd1 N1 C1 C13 4.9(4) .
C3 C2 C1 N1 -2.0(6) .
C3 C2 C1 C13 174.9(3) .
N1 C1 C13 O1 -169.4(3) .
C2 C1 C13 O1 13.6(5) .
N1 C1 C13 P1 15.8(4) .
C2 C1 C13 P1 -161.2(3) .
C14 P1 C13 O1 -88.8(3) .
Pd2 P1 C13 O1 26.0(4) .
Pd1 P1 C13 O1 160.6(3) .
C14 P1 C13 C1 85.9(3) .
Pd2 P1 C13 C1 -159.3(2) .
Pd1 P1 C13 C1 -24.7(3) .
C17 C16 C15 C14 -2.6(6) .
N1 C5 C6 O2 -150.8(3) .
C4 C5 C6 O2 30.2(5) .
N1 C5 C6 P2 29.3(4) .
C4 C5 C6 P2 -149.6(3) .
C7 P2 C6 O2 10.8(4) .
Pd2 P2 C6 O2 -103.5(3) 2_666
Pd1 P2 C6 O2 141.4(3) .
C7 P2 C6 C5 -169.3(2) .
Pd2 P2 C6 C5 76.4(2) 2_666
Pd1 P2 C6 C5 -38.8(2) .
C14 C19 C18 C17 -0.4(6) .
C18 C19 C14 C15 0.7(6) .
C18 C19 C14 P1 -173.7(3) .
C16 C15 C14 C19 0.7(6) .
C16 C15 C14 P1 175.2(3) .
C13 P1 C14 C19 -135.7(3) .
Pd2 P1 C14 C19 104.0(3) .
Pd1 P1 C14 C19 -35.6(3) .
C13 P1 C14 C15 49.9(3) .
Pd2 P1 C14 C15 -70.5(3) .
Pd1 P1 C14 C15 149.9(3) .
C15 C16 C17 C18 3.0(7) .
C19 C18 C17 C16 -1.5(7) .
Pd3 C22 C21 C20 36.6(16) .
Pd3 C20 C21 C22 -37.8(16) .
Pd3 C22A C21A C20A -33.4(13) .
C22A C21A C20A Pd3 34.0(13) .
