#------------------------------------------------------------------------------
#$Date: 2019-11-26 17:04:08 +0200 (Tue, 26 Nov 2019) $
#$Revision: 243689 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/08/95/4089569.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_4089569
loop_
_publ_author_name
'Gramigna, Kathryn M.'
'Oria, Jeremy V.'
'Mandell, Chelsea L.'
'Tiedemann, Margaret A.'
'Dougherty, William G.'
'Piro, Nicholas A.'
'Kassel, W. Scott'
'Chan, Benny C.'
'Diaconescu, Paula L.'
'Nataro, Chip'
_publ_section_title
;
 Palladium(II) and Platinum(II) Compounds of
 1,1′-Bis(phosphino)metallocene (M = Fe, Ru) Ligands with
 Metal--Metal Interactions
;
_journal_issue                   20
_journal_name_full               Organometallics
_journal_page_first              5966
_journal_paper_doi               10.1021/om400494t
_journal_volume                  32
_journal_year                    2013
_chemical_formula_sum            'C26.5 H45 Cl8 Fe P2 Pd Sb'
_chemical_formula_weight         993.16
_chemical_name_common            '[(dtbpf)PdCl][SbCl6].0.5(CH2Cl2)'
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                90
_cell_angle_beta                 98.1270(10)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.6086(3)
_cell_length_b                   17.1357(5)
_cell_length_c                   19.2749(6)
_cell_measurement_reflns_used    9843
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      33.03
_cell_measurement_theta_min      2.50
_cell_volume                     3795.69(19)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0300
_diffrn_reflns_av_unetI/netI     0.0163
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            144902
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         33.141
_diffrn_reflns_theta_min         2.134
_exptl_absorpt_coefficient_mu    2.218
_exptl_absorpt_correction_T_max  0.747
_exptl_absorpt_correction_T_min  0.495
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.738
_exptl_crystal_density_meas      ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             1972
_exptl_crystal_size_max          0.600
_exptl_crystal_size_mid          0.400
_exptl_crystal_size_min          0.100
_refine_diff_density_max         1.001
_refine_diff_density_min         -0.893
_refine_diff_density_rms         0.083
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.039
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     382
_refine_ls_number_reflns         14463
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.039
_refine_ls_R_factor_all          0.0455
_refine_ls_R_factor_gt           0.0313
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
; 
 w=1/[σ²(Fo²)+(0.0342P)²+3.5694P] 
 where P=(Fo²+2Fc²)/3 
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0749
_refine_ls_wR_factor_ref         0.0842
_reflns_Friedel_coverage         0.000
_reflns_number_gt                11570
_reflns_number_total             14463
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            om400494t_si_001.cif
_cod_data_source_block           '[Pd(dtbpf)Cl]RT'
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_crystal_density_meas' value 'not measured' was
changed to '?' -- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C26.50 H45 Cl8 Fe P2 Pd Sb'
_cod_database_code               4089569
_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. 
;
_shelx_estimated_absorpt_t_min   0.350
_shelx_estimated_absorpt_t_max   0.809
_shelxl_version_number           2013-2
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
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
Pd1 Pd 1.28475(2) -0.15750(2) -0.17315(2) 0.02792(4) Uani 1 1 d . . . . .
Fe1 Fe 1.26921(3) -0.16850(2) -0.32635(2) 0.03609(7) Uani 1 1 d . . . . .
P1 P 1.15651(5) -0.25868(3) -0.19189(3) 0.03173(10) Uani 1 1 d . . . . .
P2 P 1.40439(4) -0.05648(3) -0.19105(3) 0.03124(10) Uani 1 1 d . . . . .
Cl10 Cl 1.29518(7) -0.14801(5) -0.05283(3) 0.05501(16) Uani 1 1 d . . . . .
C11 C 1.1928(2) -0.26408(13) -0.27916(11) 0.0406(5) Uani 1 1 d . . . . .
C12 C 1.3102(3) -0.28062(15) -0.29263(15) 0.0551(7) Uani 1 1 d . . . . .
H12 H 1.3733 -0.2929 -0.2591 0.066 Uiso 1 1 calc R U . . .
C13 C 1.3120(4) -0.27483(19) -0.36511(18) 0.0771(12) Uani 1 1 d . . . . .
H13 H 1.3762 -0.2837 -0.3879 0.093 Uiso 1 1 calc R U . . .
C14 C 1.2017(4) -0.2535(2) -0.39691(15) 0.0796(12) Uani 1 1 d . . . . .
H14 H 1.1803 -0.2458 -0.4448 0.096 Uiso 1 1 calc R U . . .
C15 C 1.1270(3) -0.24524(18) -0.34550(13) 0.0582(7) Uani 1 1 d . . . . .
H15 H 1.0492 -0.2303 -0.3534 0.070 Uiso 1 1 calc R U . . .
C21 C 1.35275(18) -0.06548(13) -0.28338(11) 0.0357(4) Uani 1 1 d . . . . .
C22 C 1.4089(2) -0.09586(16) -0.33917(12) 0.0459(5) Uani 1 1 d . . . . .
H22 H 1.4862 -0.1118 -0.3352 0.055 Uiso 1 1 calc R U . . .
C23 C 1.3287(3) -0.09765(17) -0.40056(12) 0.0511(6) Uani 1 1 d . . . . .
H23 H 1.3441 -0.1142 -0.4442 0.061 Uiso 1 1 calc R U . . .
C24 C 1.2211(2) -0.07033(16) -0.38542(14) 0.0514(6) Uani 1 1 d . . . . .
H24 H 1.1535 -0.0653 -0.4173 0.062 Uiso 1 1 calc R U . . .
C25 C 1.2330(2) -0.05188(14) -0.31362(13) 0.0424(5) Uani 1 1 d . . . . .
H25 H 1.1741 -0.0340 -0.2897 0.051 Uiso 1 1 calc R U . . .
C30 C 1.1891(3) -0.35811(14) -0.15230(13) 0.0470(6) Uani 1 1 d . . . . .
C31 C 1.1394(4) -0.3663(2) -0.08362(17) 0.0864(13) Uani 1 1 d . . . . .
H31A H 1.1662 -0.4142 -0.0611 0.130 Uiso 1 1 calc R U . . .
H31B H 1.0559 -0.3667 -0.0930 0.130 Uiso 1 1 calc R U . . .
H31C H 1.1647 -0.3231 -0.0535 0.130 Uiso 1 1 calc R U . . .
C32 C 1.1405(4) -0.42261(18) -0.20255(19) 0.0718(9) Uani 1 1 d . . . . .
H32A H 1.1656 -0.4724 -0.1832 0.108 Uiso 1 1 calc R U . . .
H32B H 1.1684 -0.4157 -0.2467 0.108 Uiso 1 1 calc R U . . .
H32C H 1.0571 -0.4204 -0.2094 0.108 Uiso 1 1 calc R U . . .
C33 C 1.3209(3) -0.3663(2) -0.1364(2) 0.0797(11) Uani 1 1 d . . . . .
H33A H 1.3522 -0.3236 -0.1074 0.120 Uiso 1 1 calc R U . . .
H33B H 1.3535 -0.3659 -0.1794 0.120 Uiso 1 1 calc R U . . .
H33C H 1.3399 -0.4146 -0.1122 0.120 Uiso 1 1 calc R U . . .
C40 C 1.0029(2) -0.22548(16) -0.19380(15) 0.0481(6) Uani 1 1 d . . . . .
C41 C 0.9921(2) -0.14539(19) -0.2303(2) 0.0645(8) Uani 1 1 d . . . . .
H41A H 0.9147 -0.1256 -0.2306 0.097 Uiso 1 1 calc R U . . .
H41B H 1.0079 -0.1509 -0.2776 0.097 Uiso 1 1 calc R U . . .
H41C H 1.0470 -0.1098 -0.2055 0.097 Uiso 1 1 calc R U . . .
C42 C 0.9804(3) -0.2115(2) -0.11814(18) 0.0700(9) Uani 1 1 d . . . . .
H42A H 0.9083 -0.1840 -0.1186 0.105 Uiso 1 1 calc R U . . .
H42B H 1.0428 -0.1810 -0.0937 0.105 Uiso 1 1 calc R U . . .
H42C H 0.9762 -0.2607 -0.0949 0.105 Uiso 1 1 calc R U . . .
C43 C 0.9135(2) -0.2833(2) -0.23026(18) 0.0642(8) Uani 1 1 d . . . . .
H43A H 0.9288 -0.2923 -0.2772 0.096 Uiso 1 1 calc R U . . .
H43B H 0.8367 -0.2620 -0.2315 0.096 Uiso 1 1 calc R U . . .
H43C H 0.9188 -0.3316 -0.2049 0.096 Uiso 1 1 calc R U . . .
C50 C 1.3682(3) 0.04532(14) -0.16500(14) 0.0477(5) Uani 1 1 d . . . . .
C51 C 1.4301(5) 0.0641(2) -0.0922(2) 0.1026(17) Uani 1 1 d . . . . .
H51A H 1.4071 0.1150 -0.0785 0.154 Uiso 1 1 calc R U . . .
H51B H 1.5127 0.0633 -0.0926 0.154 Uiso 1 1 calc R U . . .
H51C H 1.4097 0.0260 -0.0595 0.154 Uiso 1 1 calc R U . . .
C52 C 1.2375(3) 0.0486(2) -0.1614(2) 0.0841(12) Uani 1 1 d . . . . .
H52A H 1.2183 0.0982 -0.1429 0.126 Uiso 1 1 calc R U . . .
H52B H 1.2169 0.0076 -0.1315 0.126 Uiso 1 1 calc R U . . .
H52C H 1.1953 0.0420 -0.2076 0.126 Uiso 1 1 calc R U . . .
C53 C 1.3989(4) 0.10501(19) -0.2179(2) 0.0838(11) Uani 1 1 d . . . . .
H53A H 1.3556 0.0940 -0.2631 0.126 Uiso 1 1 calc R U . . .
H53B H 1.4807 0.1023 -0.2208 0.126 Uiso 1 1 calc R U . . .
H53C H 1.3798 0.1564 -0.2033 0.126 Uiso 1 1 calc R U . . .
C60 C 1.56254(19) -0.08270(16) -0.17408(13) 0.0438(5) Uani 1 1 d . . . . .
C61 C 1.6047(3) -0.0794(2) -0.09492(16) 0.0654(8) Uani 1 1 d . . . . .
H61A H 1.6739 -0.1102 -0.0842 0.098 Uiso 1 1 calc R U . . .
H61B H 1.5452 -0.0996 -0.0700 0.098 Uiso 1 1 calc R U . . .
H61C H 1.6212 -0.0263 -0.0811 0.098 Uiso 1 1 calc R U . . .
C62 C 1.6390(2) -0.0299(2) -0.21322(18) 0.0628(8) Uani 1 1 d . . . . .
H62A H 1.6094 -0.0298 -0.2623 0.094 Uiso 1 1 calc R U . . .
H62B H 1.7174 -0.0492 -0.2066 0.094 Uiso 1 1 calc R U . . .
H62C H 1.6379 0.0223 -0.1952 0.094 Uiso 1 1 calc R U . . .
C63 C 1.5722(2) -0.16816(17) -0.19555(17) 0.0554(7) Uani 1 1 d . . . . .
H63A H 1.5298 -0.2004 -0.1672 0.083 Uiso 1 1 calc R U . . .
H63B H 1.6525 -0.1835 -0.1890 0.083 Uiso 1 1 calc R U . . .
H63C H 1.5403 -0.1742 -0.2440 0.083 Uiso 1 1 calc R U . . .
Sb1 Sb 1.27572(2) 0.33603(2) -0.02512(2) 0.03556(4) Uani 1 1 d . . . . .
Cl1 Cl 1.27276(10) 0.34331(6) 0.09628(4) 0.0810(3) Uani 1 1 d . . . . .
Cl2 Cl 1.28178(10) 0.32816(8) -0.14696(4) 0.0943(4) Uani 1 1 d . . . . .
Cl3 Cl 1.45251(7) 0.26631(5) -0.00583(5) 0.0698(2) Uani 1 1 d . . . . .
Cl4 Cl 1.16884(7) 0.21828(5) -0.03221(5) 0.0672(2) Uani 1 1 d . . . . .
Cl5 Cl 1.09810(7) 0.40556(6) -0.04511(7) 0.0960(4) Uani 1 1 d . . . . .
Cl6 Cl 1.38013(7) 0.45298(4) -0.02214(5) 0.0708(2) Uani 1 1 d . . . . .
C1S C 0.9221(10) -0.0004(10) -0.0139(8) 0.135(6) Uani 0.5 1 d D . P A -1
H1S1 H 0.8841 0.0397 0.0103 0.162 Uiso 0.5 1 calc R U P A -1
H1S2 H 0.8674 -0.0433 -0.0224 0.162 Uiso 0.5 1 calc R U P A -1
Cl2S Cl 0.9395(6) 0.0350(4) -0.0902(3) 0.182(2) Uani 0.5 1 d D . P A -1
Cl1S Cl 1.0295(12) -0.0314(7) 0.0398(5) 0.287(6) Uani 0.5 1 d D . 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'
P P 0.1023 0.0942 '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'
Fe Fe 0.3463 0.8444 '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'
Sb Sb -0.5866 1.5461 '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
P2 Pd1 P1 162.34(2)
P2 Pd1 Cl10 98.75(2)
P1 Pd1 Cl10 98.80(2)
P2 Pd1 Fe1 81.288(15)
P1 Pd1 Fe1 81.146(15)
Cl10 Pd1 Fe1 179.38(2)
C13 Fe1 C12 39.85(12)
C13 Fe1 C24 125.61(13)
C12 Fe1 C24 164.97(12)
C13 Fe1 C25 164.73(11)
C12 Fe1 C25 155.02(10)
C24 Fe1 C25 39.87(11)
C13 Fe1 C23 98.47(12)
C12 Fe1 C23 132.86(11)
C24 Fe1 C23 39.69(11)
C25 Fe1 C23 66.87(11)
C13 Fe1 C14 39.32(17)
C12 Fe1 C14 66.46(15)
C24 Fe1 C14 99.40(14)
C25 Fe1 C14 134.03(15)
C23 Fe1 C14 95.22(11)
C13 Fe1 C22 104.68(14)
C12 Fe1 C22 116.38(12)
C24 Fe1 C22 66.59(11)
C25 Fe1 C22 67.12(10)
C23 Fe1 C22 39.35(10)
C14 Fe1 C22 124.77(12)
C13 Fe1 C15 66.81(16)
C12 Fe1 C15 67.24(14)
C24 Fe1 C15 105.57(12)
C25 Fe1 C15 117.30(12)
C23 Fe1 C15 125.21(10)
C14 Fe1 C15 39.59(14)
C22 Fe1 C15 163.07(10)
C13 Fe1 C21 139.21(15)
C12 Fe1 C21 125.36(11)
C24 Fe1 C21 67.10(10)
C25 Fe1 C21 40.41(9)
C23 Fe1 C21 66.63(10)
C14 Fe1 C21 161.85(10)
C22 Fe1 C21 39.75(9)
C15 Fe1 C21 153.12(11)
C13 Fe1 C11 67.05(11)
C12 Fe1 C11 40.49(10)
C24 Fe1 C11 140.09(11)
C25 Fe1 C11 126.20(9)
C23 Fe1 C11 161.45(10)
C14 Fe1 C11 66.24(10)
C22 Fe1 C11 152.62(10)
C15 Fe1 C11 39.55(10)
C21 Fe1 C11 131.90(8)
C13 Fe1 Pd1 115.99(10)
C12 Fe1 Pd1 76.38(8)
C24 Fe1 Pd1 118.39(8)
C25 Fe1 Pd1 78.64(7)
C23 Fe1 Pd1 132.71(8)
C14 Fe1 Pd1 132.00(8)
C22 Fe1 Pd1 98.19(7)
C15 Fe1 Pd1 98.73(7)
C21 Fe1 Pd1 66.13(5)
C11 Fe1 Pd1 65.78(6)
C11 P1 C40 110.35(12)
C11 P1 C30 105.85(11)
C40 P1 C30 114.83(12)
C11 P1 Pd1 87.31(8)
C40 P1 Pd1 111.82(9)
C30 P1 Pd1 122.31(9)
C21 P2 C60 109.44(11)
C21 P2 C50 106.71(11)
C60 P2 C50 115.26(13)
C21 P2 Pd1 87.69(7)
C60 P2 Pd1 113.27(8)
C50 P2 Pd1 120.07(9)
C15 C11 C12 106.3(2)
C15 C11 P1 131.3(2)
C12 C11 P1 122.0(2)
C15 C11 Fe1 69.29(14)
C12 C11 Fe1 67.36(13)
P1 C11 Fe1 121.93(12)
C13 C12 C11 108.1(3)
C13 C12 Fe1 69.86(17)
C11 C12 Fe1 72.15(14)
C14 C13 C12 108.4(3)
C14 C13 Fe1 70.85(19)
C12 C13 Fe1 70.29(16)
C13 C14 C15 109.6(3)
C13 C14 Fe1 69.8(2)
C15 C14 Fe1 71.43(16)
C14 C15 C11 107.5(3)
C14 C15 Fe1 68.97(19)
C11 C15 Fe1 71.16(15)
C22 C21 C25 105.6(2)
C22 C21 P2 130.49(18)
C25 C21 P2 123.37(17)
C22 C21 Fe1 68.68(14)
C25 C21 Fe1 67.52(13)
P2 C21 Fe1 121.71(11)
C23 C22 C21 108.9(2)
C23 C22 Fe1 69.59(14)
C21 C22 Fe1 71.57(13)
C22 C23 C24 108.8(2)
C22 C23 Fe1 71.06(13)
C24 C23 Fe1 70.00(14)
C23 C24 C25 108.2(2)
C23 C24 Fe1 70.31(15)
C25 C24 Fe1 70.08(13)
C24 C25 C21 108.4(2)
C24 C25 Fe1 70.06(15)
C21 C25 Fe1 72.07(13)
C31 C30 C33 108.0(3)
C31 C30 C32 109.5(3)
C33 C30 C32 109.4(3)
C31 C30 P1 110.9(2)
C33 C30 P1 107.66(19)
C32 C30 P1 111.3(2)
C43 C40 C42 110.0(2)
C43 C40 C41 111.1(3)
C42 C40 C41 106.3(3)
C43 C40 P1 113.3(2)
C42 C40 P1 108.6(2)
C41 C40 P1 107.24(17)
C51 C50 C53 110.6(3)
C51 C50 C52 107.1(3)
C53 C50 C52 109.5(3)
C51 C50 P2 110.5(2)
C53 C50 P2 111.2(2)
C52 C50 P2 107.9(2)
C63 C60 C61 106.2(2)
C63 C60 C62 111.2(2)
C61 C60 C62 109.9(2)
C63 C60 P2 106.84(17)
C61 C60 P2 109.34(19)
C62 C60 P2 113.11(18)
Cl6 Sb1 Cl1 90.61(4)
Cl6 Sb1 Cl3 89.64(3)
Cl1 Sb1 Cl3 90.27(4)
Cl6 Sb1 Cl4 178.10(3)
Cl1 Sb1 Cl4 91.23(3)
Cl3 Sb1 Cl4 90.84(3)
Cl6 Sb1 Cl2 89.15(4)
Cl1 Sb1 Cl2 179.11(4)
Cl3 Sb1 Cl2 88.87(4)
Cl4 Sb1 Cl2 89.02(3)
Cl6 Sb1 Cl5 90.53(3)
Cl1 Sb1 Cl5 90.02(5)
Cl3 Sb1 Cl5 179.66(4)
Cl4 Sb1 Cl5 88.98(4)
Cl2 Sb1 Cl5 90.83(5)
Cl1S C1S Cl2S 121.6(10)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
Pd1 P2 2.2760(5)
Pd1 P1 2.2805(5)
Pd1 Cl10 2.3108(6)
Pd1 Fe1 2.9389(3)
Fe1 C13 2.057(3)
Fe1 C12 2.062(3)
Fe1 C24 2.064(2)
Fe1 C25 2.064(2)
Fe1 C23 2.068(2)
Fe1 C14 2.070(3)
Fe1 C22 2.087(2)
Fe1 C15 2.102(3)
Fe1 C21 2.125(2)
Fe1 C11 2.127(2)
P1 C11 1.793(2)
P1 C40 1.867(2)
P1 C30 1.883(2)
P2 C21 1.802(2)
P2 C60 1.873(2)
P2 C50 1.879(2)
C11 C15 1.431(4)
C11 C12 1.451(4)
C12 C13 1.404(4)
C13 C14 1.388(6)
C14 C15 1.413(5)
C21 C22 1.432(3)
C21 C25 1.448(3)
C22 C23 1.399(4)
C23 C24 1.402(4)
C24 C25 1.407(4)
C30 C31 1.523(4)
C30 C33 1.524(5)
C30 C32 1.524(4)
C40 C43 1.532(4)
C40 C42 1.536(4)
C40 C41 1.539(4)
C50 C51 1.518(4)
C50 C53 1.522(4)
C50 C52 1.529(4)
C60 C63 1.530(4)
C60 C61 1.536(4)
C60 C62 1.538(3)
Sb1 Cl6 2.3386(7)
Sb1 Cl1 2.3484(8)
Sb1 Cl3 2.3583(7)
Sb1 Cl4 2.3626(7)
Sb1 Cl2 2.3633(8)
Sb1 Cl5 2.3653(8)
C1S Cl1S 1.595(11)
C1S Cl2S 1.630(14)
