#------------------------------------------------------------------------------
#$Date: 2016-03-21 13:12:26 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178693 $
#$URL: svn://www.crystallography.net/cod/cif/4/08/04/4080432.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_4080432
loop_
_publ_author_name
'Tanabe, Makoto'
'Takahashi, Atsushi'
'Yamada, Tetsuyuki'
'Osakada, Kohtaro'
_publ_section_title
;
 Dipalladium Complexes with Bridging Monoalkyl or Monophenyl Silyl Ligands
 in the Solid State and in Solution
;
_journal_issue                   6
_journal_name_full               Organometallics
_journal_page_first              1815
_journal_paper_doi               10.1021/om3012486
_journal_volume                  32
_journal_year                    2013
_chemical_formula_moiety         'C48 H96 P2 Pd2 Si2'
_chemical_formula_sum            'C48 H96 P2 Pd2 Si2'
_chemical_formula_weight         1004.20
_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     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                101.664(4)
_cell_angle_beta                 108.563(4)
_cell_angle_gamma                93.8120(13)
_cell_formula_units_Z            1
_cell_length_a                   8.750(3)
_cell_length_b                   12.045(3)
_cell_length_c                   13.198(4)
_cell_measurement_reflns_used    4001
_cell_measurement_temperature    113
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      3.06
_cell_volume                     1278.5(7)
_computing_cell_refinement       CrystalClear
_computing_data_collection       'CrystalClear (Rigaku/MSC Inc., 2006)'
_computing_data_reduction        CrystalClear
_computing_molecular_graphics    'CrystalStructure 4.0'
_computing_publication_material  'CrystalStructure 4.0 (Rigaku, 2010)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      113
_diffrn_detector_area_resol_mean 7.314
_diffrn_measured_fraction_theta_full 0.955
_diffrn_measured_fraction_theta_max 0.955
_diffrn_measurement_device_type  'Rigaku Saturn70'
_diffrn_measurement_method       ω
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0336
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            10272
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.843
_exptl_absorpt_correction_T_max  0.831
_exptl_absorpt_correction_T_min  0.493
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.304
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             534.00
_exptl_crystal_size_max          0.260
_exptl_crystal_size_mid          0.240
_exptl_crystal_size_min          0.220
_refine_diff_density_max         5.180
_refine_diff_density_min         -1.640
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.094
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_parameters     297
_refine_ls_number_reflns         5606
_refine_ls_number_restraints     174
_refine_ls_R_factor_all          0.0724
_refine_ls_R_factor_gt           0.0603
_refine_ls_shift/su_max          0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[σ²(Fo²)+(0.0990P)²+1.6102P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1662
_refine_ls_wR_factor_ref         0.1798
_reflns_number_gt                4320
_reflns_number_total             5606
_reflns_threshold_expression     F²>2.0σ(F²)
_cod_data_source_file            om3012486_si_002.cif
_cod_data_source_block           1-anti
_cod_original_cell_volume        1278.5(6)
_cod_database_code               4080432
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +X,+Y,+Z
2 -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
Pd1 Pd 0.60655(5) 0.06059(3) -0.03033(3) 0.02521(16) Uani 1.0 2 d .
P1 P 0.70041(14) 0.16011(10) -0.13569(10) 0.0201(3) Uani 1.0 2 d .
Si1 Si 0.65370(18) 0.01726(12) 0.14670(11) 0.0276(4) Uani 1.0 2 d .
C1 C 0.6841(8) 0.1305(5) 0.2769(5) 0.0384(13) Uani 1.0 2 d .
C2A C 0.665(6) 0.243(5) 0.258(5) 0.089(13) Uani 0.36(2) 2 d .
C2B C 0.6187(19) 0.2421(18) 0.2589(12) 0.034(3) Uani 0.64(2) 2 d .
C3A C 0.647(5) 0.344(5) 0.364(5) 0.065(9) Uani 0.36(2) 2 d .
C3B C 0.699(3) 0.3432(19) 0.360(2) 0.050(4) Uani 0.64(2) 2 d .
C4A C 0.774(6) 0.345(3) 0.469(3) 0.106(10) Uani 0.36(2) 2 d .
C4B C 0.6592(17) 0.3340(9) 0.4628(10) 0.047(3) Uani 0.64(2) 2 d .
C5A C 0.793(4) 0.4105(15) 0.5750(16) 0.043(6) Uani 0.36(2) 2 d .
C5B C 0.714(3) 0.444(2) 0.5599(18) 0.098(6) Uani 0.64(2) 2 d .
C6A C 0.783(4) 0.5380(16) 0.572(2) 0.044(6) Uani 0.36(2) 2 d .
C6B C 0.855(4) 0.518(3) 0.581(3) 0.132(11) Uani 0.64(2) 2 d .
C7 C 0.5769(6) 0.2726(5) -0.1843(4) 0.0249(10) Uani 1.0 2 d .
C8 C 0.4499(7) 0.2312(5) -0.2996(5) 0.0322(12) Uani 1.0 2 d .
C9 C 0.3486(8) 0.3262(6) -0.3317(5) 0.0414(14) Uani 1.0 2 d .
C10 C 0.2657(8) 0.3698(6) -0.2498(6) 0.0448(15) Uani 1.0 2 d .
C11 C 0.3919(8) 0.4129(5) -0.1339(6) 0.0370(13) Uani 1.0 2 d .
C12 C 0.4900(6) 0.3167(5) -0.1022(5) 0.0267(11) Uani 1.0 2 d .
C13 C 0.7207(6) 0.0738(4) -0.2634(4) 0.0232(10) Uani 1.0 2 d .
C14 C 0.7754(7) -0.0432(5) -0.2531(5) 0.0312(12) Uani 1.0 2 d .
C15 C 0.7612(8) -0.1150(5) -0.3675(5) 0.0361(13) Uani 1.0 2 d .
C16 C 0.8588(8) -0.0520(6) -0.4210(5) 0.0390(14) Uani 1.0 2 d .
C17 C 0.8060(7) 0.0647(6) -0.4297(5) 0.0361(13) Uani 1.0 2 d .
C18 C 0.8205(7) 0.1362(5) -0.3165(4) 0.0280(11) Uani 1.0 2 d .
C19 C 0.9071(6) 0.2457(4) -0.0592(4) 0.0229(10) Uani 1.0 2 d .
C20 C 1.0341(6) 0.1670(5) -0.0217(5) 0.0271(11) Uani 1.0 2 d .
C21 C 1.2026(7) 0.2361(6) 0.0415(5) 0.0351(12) Uani 1.0 2 d .
C22 C 1.2007(7) 0.3267(5) 0.1403(5) 0.0381(13) Uani 1.0 2 d .
C23 C 1.0761(7) 0.4055(5) 0.1038(5) 0.0369(13) Uani 1.0 2 d .
C24 C 0.9047(7) 0.3374(5) 0.0391(5) 0.0291(11) Uani 1.0 2 d .
H1 H 0.7872 0.0771 0.1013 0.0452 Uiso 1.0 2 d .
H2 H 0.7517 -0.0673 0.1731 0.0613 Uiso 1.0 2 calc R
H3 H 0.6046 0.1086 0.3111 0.0461 Uiso 1.0 2 calc R
H4 H 0.7946 0.1327 0.3295 0.0461 Uiso 1.0 2 calc R
H11 H 0.2059 0.4329 -0.2715 0.0538 Uiso 1.0 2 calc R
H12 H 0.4662 0.4795 -0.1321 0.0444 Uiso 1.0 2 calc R
H13 H 0.3361 0.4377 -0.0804 0.0444 Uiso 1.0 2 calc R
H14 H 0.4158 0.2524 -0.0996 0.0321 Uiso 1.0 2 calc R
H15 H 0.5720 0.3454 -0.0278 0.0321 Uiso 1.0 2 calc R
H16 H 0.6076 0.0559 -0.3181 0.0278 Uiso 1.0 2 calc R
H17 H 0.7064 -0.0840 -0.2217 0.0374 Uiso 1.0 2 calc R
H18 H 0.8896 -0.0323 -0.2030 0.0374 Uiso 1.0 2 calc R
H19 H 0.8016 -0.1888 -0.3600 0.0434 Uiso 1.0 2 calc R
H20 H 0.6453 -0.1317 -0.4152 0.0434 Uiso 1.0 2 calc R
H21 H 0.8435 -0.0985 -0.4953 0.0468 Uiso 1.0 2 calc R
H22 H 0.9760 -0.0418 -0.3768 0.0468 Uiso 1.0 2 calc R
H23 H 0.6918 0.0545 -0.4797 0.0433 Uiso 1.0 2 calc R
H24 H 0.8752 0.1053 -0.4611 0.0433 Uiso 1.0 2 calc R
H25 H 0.7817 0.2105 -0.3240 0.0336 Uiso 1.0 2 calc R
H26 H 0.9363 0.1520 -0.2685 0.0336 Uiso 1.0 2 calc R
H29 H 1.0386 0.1114 -0.0867 0.0325 Uiso 1.0 2 calc R
H30 H 1.2809 0.1836 0.0672 0.0422 Uiso 1.0 2 calc R
H31 H 1.2395 0.2739 -0.0083 0.0422 Uiso 1.0 2 calc R
H32 H 1.1738 0.2888 0.1936 0.0457 Uiso 1.0 2 calc R
H33 H 1.3101 0.3723 0.1774 0.0457 Uiso 1.0 2 calc R
H34 H 1.1099 0.4494 0.0569 0.0443 Uiso 1.0 2 calc R
H35 H 1.0721 0.4607 0.1693 0.0443 Uiso 1.0 2 calc R
H36 H 0.8656 0.3004 0.0885 0.0350 Uiso 1.0 2 calc R
H2A1 H 0.5666 0.2362 0.1926 0.1065 Uiso 0.36(2) 2 calc R
H2A2 H 0.7596 0.2711 0.2399 0.1065 Uiso 0.36(2) 2 calc R
H3A1 H 0.6559 0.4202 0.3475 0.0779 Uiso 0.36(2) 2 calc R
H3A2 H 0.5389 0.3275 0.3702 0.0779 Uiso 0.36(2) 2 calc R
H4A1 H 0.7699 0.2648 0.4752 0.1278 Uiso 0.36(2) 2 calc R
H4A2 H 0.8788 0.3646 0.4580 0.1278 Uiso 0.36(2) 2 calc R
H5A1 H 0.8994 0.4036 0.6277 0.0520 Uiso 0.36(2) 2 calc R
H5A2 H 0.7061 0.3811 0.6000 0.0520 Uiso 0.36(2) 2 calc R
H6A1 H 0.6683 0.5486 0.5411 0.0529 Uiso 0.36(2) 2 calc R
H6A2 H 0.8427 0.5598 0.5262 0.0529 Uiso 0.36(2) 2 calc R
H6A3 H 0.8303 0.5862 0.6469 0.0529 Uiso 0.36(2) 2 calc R
H2B1 H 0.4995 0.2316 0.2432 0.0406 Uiso 0.64(2) 2 calc R
H2B2 H 0.6385 0.2606 0.1940 0.0406 Uiso 0.64(2) 2 calc R
H3B1 H 0.8190 0.3494 0.3780 0.0598 Uiso 0.64(2) 2 calc R
H3B2 H 0.6654 0.4147 0.3394 0.0598 Uiso 0.64(2) 2 calc R
H4B1 H 0.7105 0.2702 0.4904 0.0566 Uiso 0.64(2) 2 calc R
H4B2 H 0.5399 0.3134 0.4410 0.0566 Uiso 0.64(2) 2 calc R
H5B1 H 0.6230 0.4897 0.5482 0.1170 Uiso 0.64(2) 2 calc R
H5B2 H 0.7241 0.4176 0.6280 0.1170 Uiso 0.64(2) 2 calc R
H6B1 H 0.8303 0.5964 0.5877 0.1587 Uiso 0.64(2) 2 calc R
H6B2 H 0.8979 0.4970 0.5208 0.1587 Uiso 0.64(2) 2 calc R
H6B3 H 0.9364 0.5116 0.6501 0.1587 Uiso 0.64(2) 2 calc R
H5 H 0.6530 0.3380 -0.1849 0.0299 Uiso 1.0 2 calc R
H6 H 0.3767 0.1638 -0.3017 0.0387 Uiso 1.0 2 calc R
H7 H 0.5054 0.2074 -0.3535 0.0387 Uiso 1.0 2 calc R
H8 H 0.4206 0.3906 -0.3362 0.0496 Uiso 1.0 2 calc R
H9 H 0.2651 0.2961 -0.4053 0.0496 Uiso 1.0 2 calc R
H10 H 0.1860 0.3074 -0.2498 0.0538 Uiso 1.0 2 calc R
H27 H 0.9391 0.2852 -0.1106 0.0275 Uiso 1.0 2 calc R
H28 H 1.0014 0.1235 0.0260 0.0325 Uiso 1.0 2 calc R
H37 H 0.8282 0.3906 0.0127 0.0350 Uiso 1.0 2 calc R
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 for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.4)
;
Pd Pd -0.9988 1.0072
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Si Si 0.0817 0.0704
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
P P 0.1023 0.0942
;
International Tables for Crystallography
(1992, 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_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
Pd1 Pd1 P1 158.64(4) yes 2_655 .
Pd1 Pd1 Si1 53.30(4) yes 2_655 .
Pd1 Pd1 Si1 56.83(5) yes 2_655 2_655
P1 Pd1 Si1 147.40(5) yes . .
P1 Pd1 Si1 102.19(6) yes . 2_655
Si1 Pd1 Si1 110.13(6) yes . 2_655
Pd1 P1 C7 115.6(2) yes . .
Pd1 P1 C13 116.63(18) yes . .
Pd1 P1 C19 113.12(18) yes . .
C7 P1 C13 103.7(3) yes . .
C7 P1 C19 101.8(3) yes . .
C13 P1 C19 104.3(3) yes . .
Pd1 Si1 Pd1 69.87(4) yes . 2_655
Pd1 Si1 C1 123.1(2) yes . .
Pd1 Si1 C1 119.8(3) yes 2_655 .
Si1 C1 C2A 113(2) yes . .
Si1 C1 C2B 115.1(7) yes . .
C1 C2A C3A 116(5) yes . .
C1 C2B C3B 112.2(13) yes . .
C2A C3A C4A 112(4) yes . .
C2B C3B C4B 115.0(17) yes . .
C3A C4A C5A 128(4) yes . .
C3B C4B C5B 116.4(15) yes . .
C4A C5A C6A 110(3) yes . .
C4B C5B C6B 122(3) yes . .
P1 C7 C8 114.0(4) yes . .
P1 C7 C12 109.0(4) yes . .
C8 C7 C12 108.9(5) yes . .
C7 C8 C9 111.0(5) yes . .
C8 C9 C10 112.1(6) yes . .
C9 C10 C11 110.4(6) yes . .
C10 C11 C12 109.6(5) yes . .
C7 C12 C11 112.1(6) yes . .
P1 C13 C14 114.1(4) yes . .
P1 C13 C18 115.5(4) yes . .
C14 C13 C18 110.7(5) yes . .
C13 C14 C15 109.7(5) yes . .
C14 C15 C16 111.2(5) yes . .
C15 C16 C17 111.3(6) yes . .
C16 C17 C18 110.5(5) yes . .
C13 C18 C17 111.0(5) yes . .
P1 C19 C20 110.7(4) yes . .
P1 C19 C24 111.3(4) yes . .
C20 C19 C24 110.6(4) yes . .
C19 C20 C21 111.1(5) yes . .
C20 C21 C22 111.5(5) yes . .
C21 C22 C23 110.5(5) yes . .
C22 C23 C24 111.5(5) yes . .
C19 C24 C23 111.2(5) yes . .
Pd1 Pd1 H1 96.25(3) no 2_655 .
P1 Pd1 H1 104.98(4) no . .
Si1 Pd1 H1 43.27(4) no . .
Si1 Pd1 H1 152.58(5) no 2_655 .
Pd1 Si1 H1 51.90(5) no . .
Pd1 Si1 H2 118.093 no . .
Pd1 Si1 H1 121.26(8) no 2_655 .
Pd1 Si1 H2 111.998 no 2_655 .
C1 Si1 H1 99.7(3) no . .
C1 Si1 H2 108.972 no . .
H1 Si1 H2 91.065 no . .
Si1 C1 H3 108.914 no . .
Si1 C1 H4 108.920 no . .
C2A C1 H3 108.926 no . .
C2A C1 H4 108.925 no . .
C2B C1 H3 94.485 no . .
C2B C1 H4 119.993 no . .
H3 C1 H4 107.749 no . .
C1 C2A H2A1 108.200 no . .
C1 C2A H2A2 108.191 no . .
C3A C2A H2A1 108.198 no . .
C3A C2A H2A2 108.195 no . .
H2A1 C2A H2A2 107.355 no . .
C1 C2B H2B1 109.174 no . .
C1 C2B H2B2 109.176 no . .
C3B C2B H2B1 109.174 no . .
C3B C2B H2B2 109.181 no . .
H2B1 C2B H2B2 107.892 no . .
C2A C3A H3A1 109.275 no . .
C2A C3A H3A2 109.275 no . .
C4A C3A H3A1 109.282 no . .
C4A C3A H3A2 109.278 no . .
H3A1 C3A H3A2 107.947 no . .
C2B C3B H3B1 108.512 no . .
C2B C3B H3B2 108.511 no . .
C4B C3B H3B1 108.519 no . .
C4B C3B H3B2 108.517 no . .
H3B1 C3B H3B2 107.515 no . .
C3A C4A H4A1 105.229 no . .
C3A C4A H4A2 105.231 no . .
C5A C4A H4A1 105.227 no . .
C5A C4A H4A2 105.219 no . .
H4A1 C4A H4A2 105.945 no . .
C3B C4B H4B1 108.197 no . .
C3B C4B H4B2 108.198 no . .
C5B C4B H4B1 108.193 no . .
C5B C4B H4B2 108.186 no . .
H4B1 C4B H4B2 107.342 no . .
C4A C5A H5A1 109.750 no . .
C4A C5A H5A2 109.745 no . .
C6A C5A H5A1 109.743 no . .
C6A C5A H5A2 109.749 no . .
H5A1 C5A H5A2 108.206 no . .
C4B C5B H5B1 106.956 no . .
C4B C5B H5B2 106.948 no . .
C6B C5B H5B1 106.962 no . .
C6B C5B H5B2 106.951 no . .
H5B1 C5B H5B2 106.716 no . .
C5A C6A H6A1 109.470 no . .
C5A C6A H6A2 109.468 no . .
C5A C6A H6A3 109.478 no . .
H6A1 C6A H6A2 109.467 no . .
H6A1 C6A H6A3 109.473 no . .
H6A2 C6A H6A3 109.472 no . .
C5B C6B H6B1 109.472 no . .
C5B C6B H6B2 109.469 no . .
C5B C6B H6B3 109.481 no . .
H6B1 C6B H6B2 109.467 no . .
H6B1 C6B H6B3 109.470 no . .
H6B2 C6B H6B3 109.469 no . .
P1 C7 H5 108.244 no . .
C8 C7 H5 108.240 no . .
C12 C7 H5 108.244 no . .
C7 C8 H6 109.427 no . .
C7 C8 H7 109.431 no . .
C9 C8 H6 109.426 no . .
C9 C8 H7 109.431 no . .
H6 C8 H7 108.031 no . .
C8 C9 H8 109.192 no . .
C8 C9 H9 109.201 no . .
C10 C9 H8 109.195 no . .
C10 C9 H9 109.201 no . .
H8 C9 H9 107.905 no . .
C9 C10 H11 109.577 no . .
C9 C10 H10 109.576 no . .
C11 C10 H11 109.585 no . .
C11 C10 H10 109.582 no . .
H11 C10 H10 108.122 no . .
C10 C11 H12 109.747 no . .
C10 C11 H13 109.744 no . .
C12 C11 H12 109.744 no . .
C12 C11 H13 109.737 no . .
H12 C11 H13 108.214 no . .
C7 C12 H14 109.185 no . .
C7 C12 H15 109.189 no . .
C11 C12 H14 109.184 no . .
C11 C12 H15 109.185 no . .
H14 C12 H15 107.895 no . .
P1 C13 H16 105.128 no . .
C14 C13 H16 105.122 no . .
C18 C13 H16 105.129 no . .
C13 C14 H17 109.736 no . .
C13 C14 H18 109.732 no . .
C15 C14 H17 109.732 no . .
C15 C14 H18 109.728 no . .
H17 C14 H18 108.209 no . .
C14 C15 H19 109.394 no . .
C14 C15 H20 109.398 no . .
C16 C15 H19 109.392 no . .
C16 C15 H20 109.389 no . .
H19 C15 H20 108.007 no . .
C15 C16 H21 109.357 no . .
C15 C16 H22 109.357 no . .
C17 C16 H21 109.371 no . .
C17 C16 H22 109.365 no . .
H21 C16 H22 107.996 no . .
C16 C17 H23 109.557 no . .
C16 C17 H24 109.557 no . .
C18 C17 H23 109.560 no . .
C18 C17 H24 109.566 no . .
H23 C17 H24 108.108 no . .
C13 C18 H25 109.435 no . .
C13 C18 H26 109.430 no . .
C17 C18 H25 109.432 no . .
C17 C18 H26 109.433 no . .
H25 C18 H26 108.039 no . .
P1 C19 H27 108.037 no . .
C20 C19 H27 108.029 no . .
C24 C19 H27 108.038 no . .
C19 C20 H29 109.422 no . .
C19 C20 H28 109.419 no . .
C21 C20 H29 109.418 no . .
C21 C20 H28 109.420 no . .
H29 C20 H28 108.031 no . .
C20 C21 H30 109.327 no . .
C20 C21 H31 109.327 no . .
C22 C21 H30 109.321 no . .
C22 C21 H31 109.324 no . .
H30 C21 H31 107.972 no . .
C21 C22 H32 109.552 no . .
C21 C22 H33 109.553 no . .
C23 C22 H32 109.546 no . .
C23 C22 H33 109.548 no . .
H32 C22 H33 108.100 no . .
C22 C23 H34 109.325 no . .
C22 C23 H35 109.322 no . .
C24 C23 H34 109.328 no . .
C24 C23 H35 109.319 no . .
H34 C23 H35 107.973 no . .
C19 C24 H36 109.401 no . .
C19 C24 H37 109.393 no . .
C23 C24 H36 109.399 no . .
C23 C24 H37 109.396 no . .
H36 C24 H37 108.011 no . .
Pd1 H1 Si1 84.83(5) no . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_2
Pd1 Pd1 2.7036(8) yes 2_655
Pd1 P1 2.3055(16) yes .
Pd1 Si1 2.4104(17) yes .
Pd1 Si1 2.3089(14) yes 2_655
P1 C7 1.876(6) yes .
P1 C13 1.860(6) yes .
P1 C19 1.877(5) yes .
Si1 C1 1.897(6) yes .
C1 C2A 1.44(6) yes .
C1 C2B 1.53(3) yes .
C2A C3A 1.71(8) yes .
C2B C3B 1.54(3) yes .
C3A C4A 1.47(6) yes .
C3B C4B 1.53(4) yes .
C4A C5A 1.41(4) yes .
C4B C5B 1.57(3) yes .
C5A C6A 1.55(3) yes .
C5B C6B 1.39(5) yes .
C7 C8 1.531(7) yes .
C7 C12 1.543(9) yes .
C8 C9 1.538(9) yes .
C9 C10 1.514(11) yes .
C10 C11 1.535(8) yes .
C11 C12 1.534(8) yes .
C13 C14 1.537(8) yes .
C13 C18 1.528(9) yes .
C14 C15 1.544(8) yes .
C15 C16 1.522(11) yes .
C16 C17 1.524(10) yes .
C17 C18 1.528(8) yes .
C19 C20 1.536(8) yes .
C19 C24 1.531(8) yes .
C20 C21 1.528(7) yes .
C21 C22 1.527(9) yes .
C22 C23 1.520(9) yes .
C23 C24 1.545(7) yes .
Pd1 H1 1.9045(5) no .
Si1 H1 1.6590(18) no .
Si1 H2 1.401 no .
C1 H3 0.990 no .
C1 H4 0.990 no .
C2A H2A1 0.990 no .
C2A H2A2 0.990 no .
C2B H2B1 0.990 no .
C2B H2B2 0.990 no .
C3A H3A1 0.990 no .
C3A H3A2 0.990 no .
C3B H3B1 0.990 no .
C3B H3B2 0.990 no .
C4A H4A1 0.990 no .
C4A H4A2 0.990 no .
C4B H4B1 0.990 no .
C4B H4B2 0.990 no .
C5A H5A1 0.990 no .
C5A H5A2 0.990 no .
C5B H5B1 0.990 no .
C5B H5B2 0.990 no .
C6A H6A1 0.980 no .
C6A H6A2 0.980 no .
C6A H6A3 0.980 no .
C6B H6B1 0.980 no .
C6B H6B2 0.980 no .
C6B H6B3 0.980 no .
C7 H5 1.000 no .
C8 H6 0.990 no .
C8 H7 0.990 no .
C9 H8 0.990 no .
C9 H9 0.990 no .
C10 H11 0.990 no .
C10 H10 0.990 no .
C11 H12 0.990 no .
C11 H13 0.990 no .
C12 H14 0.990 no .
C12 H15 0.990 no .
C13 H16 1.000 no .
C14 H17 0.990 no .
C14 H18 0.990 no .
C15 H19 0.990 no .
C15 H20 0.990 no .
C16 H21 0.990 no .
C16 H22 0.990 no .
C17 H23 0.990 no .
C17 H24 0.990 no .
C18 H25 0.990 no .
C18 H26 0.990 no .
C19 H27 1.000 no .
C20 H29 0.990 no .
C20 H28 0.990 no .
C21 H30 0.990 no .
C21 H31 0.990 no .
C22 H32 0.990 no .
C22 H33 0.990 no .
C23 H34 0.990 no .
C23 H35 0.990 no .
C24 H36 0.990 no .
C24 H37 0.990 no .
