 
data_04src0161
 
_audit_creation_method            SHELXL-97
_chemical_name_systematic
;
 ?
;
_chemical_name_common             ?
_chemical_melting_point           ?
_chemical_formula_moiety          'C24 H58 Cl2 N0 O4 P4 Pd2'
_chemical_formula_sum
 'C24 H58 Cl2 N0 O4 P4 Pd2'
_chemical_formula_weight          818.28
 
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'
 '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'
 'Cl'  'Cl'   0.1484   0.1585
 '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'
 
_symmetry_cell_setting            Monoclinic
_symmetry_space_group_name_H-M    P2(1)/c
_symmetry_space_group_name_hall   '-P 2ybc'
 
loop_
 _symmetry_equiv_pos_as_xyz
 'x, y, z'
 '-x, y+1/2, -z+1/2'
 '-x, -y, -z'
 'x, -y-1/2, z-1/2'
 
_cell_length_a                    18.829(2)
_cell_length_b                    22.723(2)
_cell_length_c                    17.2919(10)
_cell_angle_alpha                 90.00
_cell_angle_beta                  110.3480(10)
_cell_angle_gamma                 90.00
_cell_volume                      6937.7(10)
_cell_formula_units_Z             8
_cell_measurement_temperature     120(2)
_cell_measurement_reflns_used     86668
_cell_measurement_theta_min       2.91
_cell_measurement_theta_max       27.48
 
_exptl_crystal_description        block
_exptl_crystal_colour             colourless
_exptl_crystal_size_max           0.36
_exptl_crystal_size_mid           0.20
_exptl_crystal_size_min           0.14
_exptl_crystal_density_meas       ?
_exptl_crystal_density_diffrn     1.567
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000              3360
_exptl_absorpt_coefficient_mu     1.402
_exptl_absorpt_correction_type    multi-scan
_exptl_absorpt_correction_T_min   0.6322
_exptl_absorpt_correction_T_max   0.8279
_exptl_absorpt_process_details    'SORTAV (R.H.Blessing, 1995, 1997)'
 
_exptl_special_details
;
 ?
;
 
_diffrn_ambient_temperature       120(2)
_diffrn_radiation_wavelength      0.71073
_diffrn_radiation_type            MoK\a
_diffrn_radiation_source          'Bruker-Nonius FR591 rotating anode'
_diffrn_radiation_monochromator   graphite
_diffrn_measurement_device_type   'Bruker-Nonius KappaCCD Area Detector'
_diffrn_measurement_method        'φ and ω scans to fill Ewald Sphere'
_diffrn_detector_area_resol_mean  9.091
_diffrn_standards_decay_%         negligible
_diffrn_reflns_number             83029
_diffrn_reflns_av_R_equivalents   0.0554
_diffrn_reflns_av_sigmaI/netI     0.0386
_diffrn_reflns_limit_h_min        -24
_diffrn_reflns_limit_h_max        24
_diffrn_reflns_limit_k_min        -27
_diffrn_reflns_limit_k_max        29
_diffrn_reflns_limit_l_min        -22
_diffrn_reflns_limit_l_max        19
_diffrn_reflns_theta_min          2.92
_diffrn_reflns_theta_max          27.50
_reflns_number_total              15834
_reflns_number_gt                 12228
_reflns_threshold_expression      >2σ(I)
 
_computing_data_collection        
;
'DENZO (Otwinowski and Minor, 1997) & COLLECT (Hooft, 1998) '
;
_computing_cell_refinement        'DENZO and COLLECT'
_computing_data_reduction         'DENZO and COLLECT'
_computing_structure_solution     'SHELXS-97 (Sheldrick, 2008)' 
_computing_structure_refinement   'SHELXL-97 (Sheldrick, 2008)' 
_computing_molecular_graphics     'PLATON (Watkin, Pearce 1995)'
_computing_publication_material   SHELXL-97
 
_refine_special_details
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² 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
_refine_ls_weighting_details
 'calc w=1/[σ²(Fo²)+(0.0322P)²+3.5975P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary      direct
_atom_sites_solution_secondary    difmap
_atom_sites_solution_hydrogens    geom
_refine_ls_hydrogen_treatment     mixed
_refine_ls_extinction_method      SHELXL
_refine_ls_extinction_coef        0.00065(4)
_refine_ls_extinction_expression
 'Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^'
_refine_ls_number_reflns          15834
_refine_ls_number_parameters      709
_refine_ls_number_restraints      0
_refine_ls_R_factor_all           0.0477
_refine_ls_R_factor_gt            0.0303
_refine_ls_wR_factor_ref          0.0729
_refine_ls_wR_factor_gt           0.0658
_refine_ls_goodness_of_fit_ref    1.011
_refine_ls_restrained_S_all       1.011
_refine_ls_shift/su_max           0.004
_refine_ls_shift/su_mean          0.000
 
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
 _atom_site_disorder_assembly
 _atom_site_disorder_group
C1 C 0.52034(14) 0.43147(11) 0.13331(15) 0.0202(5) Uani 1 1 d . . .
H1 H 0.5379 0.4075 0.1850 0.024 Uiso 1 1 calc R . .
C2 C 0.57265(15) 0.48506(13) 0.14502(17) 0.0285(6) Uani 1 1 d . . .
H2A H 0.6248 0.4717 0.1563 0.043 Uiso 1 1 calc R . .
H2B H 0.5704 0.5087 0.1915 0.043 Uiso 1 1 calc R . .
H2C H 0.5562 0.5090 0.0948 0.043 Uiso 1 1 calc R . .
C3 C 0.52421(15) 0.39338(12) 0.06226(17) 0.0262(6) Uani 1 1 d . . .
H3A H 0.5081 0.4165 0.0113 0.039 Uiso 1 1 calc R . .
H3B H 0.4907 0.3593 0.0556 0.039 Uiso 1 1 calc R . .
H3C H 0.5763 0.3798 0.0742 0.039 Uiso 1 1 calc R . .
C4 C 0.42246(14) 0.49659(11) 0.20446(15) 0.0223(6) Uani 1 1 d . . .
H4 H 0.4572 0.5307 0.2088 0.027 Uiso 1 1 calc R . .
C5 C 0.34510(17) 0.52275(15) 0.18985(19) 0.0432(8) Uani 1 1 d . . .
H5A H 0.3108 0.4920 0.1955 0.065 Uiso 1 1 calc R . .
H5B H 0.3252 0.5394 0.1342 0.065 Uiso 1 1 calc R . .
H5C H 0.3492 0.5538 0.2304 0.065 Uiso 1 1 calc R . .
C6 C 0.45332(19) 0.46433(13) 0.28670(17) 0.0369(7) Uani 1 1 d . . .
H6A H 0.4555 0.4915 0.3315 0.055 Uiso 1 1 calc R . .
H6B H 0.5043 0.4496 0.2947 0.055 Uiso 1 1 calc R . .
H6C H 0.4200 0.4312 0.2867 0.055 Uiso 1 1 calc R . .
C7 C 0.25580(14) 0.36377(12) -0.11330(15) 0.0220(6) Uani 1 1 d . . .
H7 H 0.2365 0.3246 -0.1031 0.026 Uiso 1 1 calc R . .
C8 C 0.33325(15) 0.35528(13) -0.12146(17) 0.0295(6) Uani 1 1 d . . .
H8A H 0.3286 0.3283 -0.1672 0.044 Uiso 1 1 calc R . .
H8B H 0.3685 0.3387 -0.0701 0.044 Uiso 1 1 calc R . .
H8C H 0.3524 0.3933 -0.1323 0.044 Uiso 1 1 calc R . .
C9 C 0.19992(17) 0.38962(14) -0.19299(17) 0.0359(7) Uani 1 1 d . . .
H9A H 0.2155 0.4297 -0.2006 0.054 Uiso 1 1 calc R . .
H9B H 0.1491 0.3905 -0.1895 0.054 Uiso 1 1 calc R . .
H9C H 0.1994 0.3652 -0.2399 0.054 Uiso 1 1 calc R . .
C10 C 0.17020(14) 0.41863(12) -0.01917(17) 0.0277(6) Uani 1 1 d . . .
H10 H 0.1405 0.4440 -0.0666 0.033 Uiso 1 1 calc R . .
C11 C 0.17195(17) 0.45123(15) 0.05865(19) 0.0399(8) Uani 1 1 d . . .
H11A H 0.1200 0.4602 0.0553 0.060 Uiso 1 1 calc R . .
H11B H 0.2005 0.4880 0.0636 0.060 Uiso 1 1 calc R . .
H11C H 0.1964 0.4265 0.1070 0.060 Uiso 1 1 calc R . .
C12 C 0.12649(16) 0.36131(14) -0.0289(2) 0.0449(8) Uani 1 1 d . . .
H12A H 0.1552 0.3336 0.0140 0.067 Uiso 1 1 calc R . .
H12B H 0.1189 0.3445 -0.0833 0.067 Uiso 1 1 calc R . .
H12C H 0.0772 0.3689 -0.0235 0.067 Uiso 1 1 calc R . .
C13 C 0.56362(15) 0.20112(12) 0.31805(15) 0.0239(6) Uani 1 1 d . . .
H13 H 0.6128 0.1793 0.3391 0.029 Uiso 1 1 calc R . .
C14 C 0.50906(18) 0.16652(14) 0.34770(18) 0.0377(7) Uani 1 1 d . . .
H14A H 0.5296 0.1635 0.4080 0.057 Uiso 1 1 calc R . .
H14B H 0.5023 0.1270 0.3235 0.057 Uiso 1 1 calc R . .
H14C H 0.4601 0.1868 0.3308 0.057 Uiso 1 1 calc R . .
C15 C 0.57924(15) 0.26131(13) 0.35974(16) 0.0284(6) Uani 1 1 d . . .
H15A H 0.5312 0.2801 0.3554 0.043 Uiso 1 1 calc R . .
H15B H 0.6062 0.2860 0.3325 0.043 Uiso 1 1 calc R . .
H15C H 0.6104 0.2565 0.4180 0.043 Uiso 1 1 calc R . .
C16 C 0.60051(13) 0.24823(12) 0.17850(15) 0.0215(5) Uani 1 1 d . . .
H16 H 0.5904 0.2898 0.1908 0.026 Uiso 1 1 calc R . .
C17 C 0.58567(15) 0.24247(13) 0.08603(16) 0.0257(6) Uani 1 1 d . . .
H17A H 0.6217 0.2671 0.0712 0.039 Uiso 1 1 calc R . .
H17B H 0.5339 0.2553 0.0549 0.039 Uiso 1 1 calc R . .
H17C H 0.5919 0.2013 0.0727 0.039 Uiso 1 1 calc R . .
C18 C 0.68314(15) 0.23313(14) 0.22785(17) 0.0327(7) Uani 1 1 d . . .
H18A H 0.6924 0.1915 0.2197 0.049 Uiso 1 1 calc R . .
H18B H 0.6933 0.2405 0.2866 0.049 Uiso 1 1 calc R . .
H18C H 0.7166 0.2577 0.2089 0.049 Uiso 1 1 calc R . .
C19 C 0.31920(15) 0.10192(12) 0.08788(17) 0.0251(6) Uani 1 1 d . . .
H19 H 0.3101 0.0659 0.0525 0.030 Uiso 1 1 calc R . .
C20 C 0.24269(18) 0.12970(14) 0.0722(3) 0.0522(10) Uani 1 1 d . . .
H20A H 0.2094 0.1015 0.0857 0.078 Uiso 1 1 calc R . .
H20B H 0.2204 0.1409 0.0140 0.078 Uiso 1 1 calc R . .
H20C H 0.2485 0.1648 0.1068 0.078 Uiso 1 1 calc R . .
C21 C 0.3555(2) 0.08120(15) 0.1761(2) 0.0474(9) Uani 1 1 d . . .
H21A H 0.3628 0.1148 0.2135 0.071 Uiso 1 1 calc R . .
H21B H 0.4047 0.0632 0.1833 0.071 Uiso 1 1 calc R . .
H21C H 0.3226 0.0521 0.1886 0.071 Uiso 1 1 calc R . .
C22 C 0.34246(15) 0.16320(12) -0.05069(15) 0.0250(6) Uani 1 1 d . . .
H22 H 0.2972 0.1887 -0.0587 0.030 Uiso 1 1 calc R . .
C23 C 0.31622(18) 0.10651(14) -0.10007(17) 0.0369(7) Uani 1 1 d . . .
H23A H 0.2970 0.1157 -0.1591 0.055 Uiso 1 1 calc R . .
H23B H 0.2759 0.0883 -0.0846 0.055 Uiso 1 1 calc R . .
H23C H 0.3590 0.0792 -0.0881 0.055 Uiso 1 1 calc R . .
C24 C 0.39784(17) 0.19657(14) -0.08121(17) 0.0341(7) Uani 1 1 d . . .
H24A H 0.4434 0.1727 -0.0720 0.051 Uiso 1 1 calc R . .
H24B H 0.4118 0.2337 -0.0510 0.051 Uiso 1 1 calc R . .
H24C H 0.3739 0.2048 -0.1403 0.051 Uiso 1 1 calc R . .
C25 C 0.19245(14) 0.60718(12) -0.06101(16) 0.0240(6) Uani 1 1 d . . .
H25 H 0.1974 0.5719 -0.0249 0.029 Uiso 1 1 calc R . .
C26 C 0.27042(16) 0.63612(13) -0.0326(2) 0.0361(7) Uani 1 1 d . . .
H26A H 0.3089 0.6066 -0.0310 0.054 Uiso 1 1 calc R . .
H26B H 0.2814 0.6528 0.0226 0.054 Uiso 1 1 calc R . .
H26C H 0.2711 0.6675 -0.0712 0.054 Uiso 1 1 calc R . .
C27 C 0.1698(2) 0.58373(15) -0.14847(19) 0.0478(9) Uani 1 1 d . . .
H27A H 0.1690 0.6161 -0.1862 0.072 Uiso 1 1 calc R . .
H27B H 0.1193 0.5660 -0.1644 0.072 Uiso 1 1 calc R . .
H27C H 0.2064 0.5539 -0.1513 0.072 Uiso 1 1 calc R . .
C28 C 0.14715(14) 0.67805(11) 0.05658(15) 0.0212(5) Uani 1 1 d . . .
H28 H 0.1900 0.7060 0.0642 0.025 Uiso 1 1 calc R . .
C29 C 0.17543(17) 0.62746(13) 0.11830(17) 0.0327(7) Uani 1 1 d . . .
H29A H 0.1860 0.6423 0.1744 0.049 Uiso 1 1 calc R . .
H29B H 0.2219 0.6110 0.1137 0.049 Uiso 1 1 calc R . .
H29C H 0.1365 0.5968 0.1063 0.049 Uiso 1 1 calc R . .
C30 C 0.08302(15) 0.71112(13) 0.07266(17) 0.0290(6) Uani 1 1 d . . .
H30A H 0.0401 0.6845 0.0644 0.044 Uiso 1 1 calc R . .
H30B H 0.0670 0.7444 0.0344 0.044 Uiso 1 1 calc R . .
H30C H 0.1008 0.7257 0.1295 0.044 Uiso 1 1 calc R . .
C31 C -0.10759(14) 0.74244(12) -0.19757(16) 0.0246(6) Uani 1 1 d . . .
H31 H -0.1074 0.7773 -0.2328 0.030 Uiso 1 1 calc R . .
C32 C -0.08888(17) 0.76381(14) -0.10898(18) 0.0378(8) Uani 1 1 d . . .
H32A H -0.1288 0.7905 -0.1062 0.057 Uiso 1 1 calc R . .
H32B H -0.0403 0.7846 -0.0912 0.057 Uiso 1 1 calc R . .
H32C H -0.0856 0.7300 -0.0727 0.057 Uiso 1 1 calc R . .
C33 C -0.18674(15) 0.71493(15) -0.22969(19) 0.0376(7) Uani 1 1 d . . .
H33A H -0.1879 0.6803 -0.1965 0.056 Uiso 1 1 calc R . .
H33B H -0.1989 0.7032 -0.2874 0.056 Uiso 1 1 calc R . .
H33C H -0.2241 0.7437 -0.2258 0.056 Uiso 1 1 calc R . .
C34 C -0.0508(2) 0.6821(2) -0.31384(19) 0.0679(14) Uani 1 1 d . . .
H34 H -0.0910 0.6510 -0.3301 0.082 Uiso 1 1 calc R A 1
C35 C 0.0155(2) 0.64994(17) -0.32619(19) 0.0526(10) Uani 1 1 d . B .
H35A H 0.0252 0.6132 -0.2946 0.079 Uiso 1 1 calc R . .
H35B H 0.0607 0.6749 -0.3070 0.079 Uiso 1 1 calc R . .
H35C H 0.0033 0.6411 -0.3849 0.079 Uiso 1 1 calc R . .
C36 C -0.0843(3) 0.7260(2) -0.3693(3) 0.0306(13) Uani 0.650(7) 1 d P B 1
H36A H -0.0953 0.7114 -0.4255 0.046 Uiso 0.650(7) 1 calc PR B 1
H36B H -0.0499 0.7597 -0.3596 0.046 Uiso 0.650(7) 1 calc PR B 1
H36C H -0.1316 0.7382 -0.3621 0.046 Uiso 0.650(7) 1 calc PR B 1
C36' C -0.1153(4) 0.6770(4) -0.3797(5) 0.037(3) Uani 0.350(7) 1 d P B 2
H36D H -0.1494 0.7095 -0.3796 0.055 Uiso 0.350(7) 1 calc PR B 2
H36E H -0.1399 0.6395 -0.3768 0.055 Uiso 0.350(7) 1 calc PR B 2
H36F H -0.1033 0.6784 -0.4304 0.055 Uiso 0.350(7) 1 calc PR B 2
C37 C 0.06274(14) 0.99015(11) -0.23230(15) 0.0202(5) Uani 1 1 d . . .
H37 H 0.0353 1.0281 -0.2338 0.024 Uiso 1 1 calc R . .
C38 C 0.01603(15) 0.95558(13) -0.30934(16) 0.0280(6) Uani 1 1 d . . .
H38A H 0.0092 0.9795 -0.3586 0.042 Uiso 1 1 calc R . .
H38B H -0.0336 0.9461 -0.3061 0.042 Uiso 1 1 calc R . .
H38C H 0.0426 0.9191 -0.3126 0.042 Uiso 1 1 calc R . .
C39 C 0.13994(14) 1.00623(12) -0.23587(17) 0.0278(6) Uani 1 1 d . . .
H39A H 0.1657 0.9705 -0.2438 0.042 Uiso 1 1 calc R . .
H39B H 0.1704 1.0253 -0.1841 0.042 Uiso 1 1 calc R . .
H39C H 0.1335 1.0333 -0.2820 0.042 Uiso 1 1 calc R . .
C40 C -0.02236(13) 0.93655(11) -0.13516(15) 0.0175(5) Uani 1 1 d . . .
H40 H -0.0431 0.9047 -0.1768 0.021 Uiso 1 1 calc R . .
C41 C -0.07643(14) 0.98910(12) -0.15918(16) 0.0240(6) Uani 1 1 d . . .
H41A H -0.1251 0.9782 -0.1544 0.036 Uiso 1 1 calc R . .
H41B H -0.0842 1.0005 -0.2162 0.036 Uiso 1 1 calc R . .
H41C H -0.0546 1.0222 -0.1223 0.036 Uiso 1 1 calc R . .
C42 C -0.01683(15) 0.91275(12) -0.05053(15) 0.0242(6) Uani 1 1 d . . .
H42A H 0.0013 0.9439 -0.0092 0.036 Uiso 1 1 calc R . .
H42B H 0.0186 0.8796 -0.0359 0.036 Uiso 1 1 calc R . .
H42C H -0.0669 0.8995 -0.0524 0.036 Uiso 1 1 calc R . .
C43 C 0.32075(13) 0.90042(12) -0.02969(16) 0.0222(6) Uani 1 1 d . . .
H43 H 0.3263 0.8568 -0.0327 0.027 Uiso 1 1 calc R . .
C44 C 0.39385(15) 0.92350(15) 0.0342(2) 0.0407(8) Uani 1 1 d . . .
H44A H 0.4359 0.9178 0.0138 0.061 Uiso 1 1 calc R . .
H44B H 0.4043 0.9020 0.0860 0.061 Uiso 1 1 calc R . .
H44C H 0.3883 0.9655 0.0436 0.061 Uiso 1 1 calc R . .
C45 C 0.31047(16) 0.92490(13) -0.11457(18) 0.0322(7) Uani 1 1 d . . .
H45A H 0.3038 0.9677 -0.1144 0.048 Uiso 1 1 calc R . .
H45B H 0.2656 0.9071 -0.1554 0.048 Uiso 1 1 calc R . .
H45C H 0.3553 0.9157 -0.1288 0.048 Uiso 1 1 calc R . .
C46 C 0.24904(14) 0.87384(12) 0.09360(16) 0.0239(6) Uani 1 1 d . . .
H46 H 0.2766 0.8364 0.0927 0.029 Uiso 1 1 calc R . .
C47 C 0.29645(18) 0.90951(16) 0.16953(18) 0.0456(9) Uani 1 1 d . . .
H47A H 0.2693 0.9457 0.1729 0.068 Uiso 1 1 calc R . .
H47B H 0.3453 0.9196 0.1646 0.068 Uiso 1 1 calc R . .
H47C H 0.3049 0.8860 0.2195 0.068 Uiso 1 1 calc R . .
C48 C 0.17352(15) 0.85828(14) 0.10230(17) 0.0321(7) Uani 1 1 d . . .
H48A H 0.1826 0.8362 0.1535 0.048 Uiso 1 1 calc R . .
H48B H 0.1437 0.8342 0.0552 0.048 Uiso 1 1 calc R . .
H48C H 0.1457 0.8945 0.1038 0.048 Uiso 1 1 calc R . .
O1 O 0.40424(10) 0.50085(8) 0.04421(11) 0.0231(4) Uani 1 1 d . . .
O2 O 0.28224(10) 0.47411(8) -0.05146(10) 0.0241(4) Uani 1 1 d . . .
O3 O 0.55446(10) 0.13594(8) 0.18742(11) 0.0230(4) Uani 1 1 d . . .
O4 O 0.45313(10) 0.10474(8) 0.06516(11) 0.0248(4) Uani 1 1 d . . .
O5 O 0.05256(10) 0.60467(8) -0.05524(11) 0.0281(4) Uani 1 1 d . . .
O6 O -0.05380(11) 0.63038(8) -0.17458(14) 0.0413(6) Uani 1 1 d . . .
O7 O 0.10085(10) 1.00631(7) -0.06994(11) 0.0219(4) Uani 1 1 d . . .
O8 O 0.22954(10) 0.97961(8) 0.01272(11) 0.0246(4) Uani 1 1 d . . .
P6 P -0.03544(4) 0.69055(3) -0.20416(4) 0.02141(15) Uani 1 1 d . B .
H04 H 0.154(2) 0.9971(16) -0.039(2) 0.068(12) Uiso 1 1 d . . .
H01 H 0.348(2) 0.4915(17) 0.000(2) 0.073(12) Uiso 1 1 d . . .
H02 H 0.500(3) 0.115(2) 0.120(3) 0.093(15) Uiso 1 1 d . . .
H03 H -0.004(3) 0.613(2) -0.114(3) 0.109(16) Uiso 1 1 d . . .
P1 P 0.42246(3) 0.45460(3) 0.11426(4) 0.01576(13) Uani 1 1 d . . .
P2 P 0.26497(3) 0.41224(3) -0.02540(4) 0.01818(14) Uani 1 1 d . . .
P3 P 0.53466(3) 0.19928(3) 0.20497(4) 0.01648(13) Uani 1 1 d . . .
P4 P 0.38664(3) 0.14705(3) 0.05949(4) 0.01691(13) Uani 1 1 d . . .
P5 P 0.11490(3) 0.65095(3) -0.05009(4) 0.01674(13) Uani 1 1 d . B .
P7 P 0.07287(3) 0.95515(3) -0.13350(4) 0.01510(13) Uani 1 1 d . B .
P8 P 0.23578(3) 0.91376(3) -0.00318(4) 0.01796(14) Uani 1 1 d . B .
Cl1 Cl 0.43779(3) 0.32303(3) 0.20924(3) 0.01959(13) Uani 1 1 d . . .
Cl2 Cl 0.29197(3) 0.27498(3) 0.06140(4) 0.02014(13) Uani 1 1 d . . .
Cl3 Cl 0.20355(3) 0.77631(3) -0.07351(4) 0.02023(13) Uani 1 1 d . B .
Cl4 Cl 0.04804(3) 0.81742(3) -0.21915(3) 0.02042(13) Uani 1 1 d . B .
Pd1 Pd 0.350749(10) 0.372200(8) 0.088552(11) 0.01363(5) Uani 1 1 d . . .
Pd2 Pd 0.415565(10) 0.230836(8) 0.134830(10) 0.01297(5) Uani 1 1 d . . .
Pd3 Pd 0.080675(10) 0.728438(8) -0.136903(11) 0.01387(5) Uani 1 1 d . . .
Pd4 Pd 0.140773(9) 0.871270(8) -0.106197(11) 0.01343(5) Uani 1 1 d . . .
 
 
_geom_special_details
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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
C1 C3 1.525(4) . ?
C1 C2 1.535(4) . ?
C1 P1 1.833(3) . ?
C1 H1 1.0000 . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 H2C 0.9800 . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 C5 1.511(4) . ?
C4 C6 1.524(4) . ?
C4 P1 1.828(2) . ?
C4 H4 1.0000 . ?
C5 H5A 0.9800 . ?
C5 H5B 0.9800 . ?
C5 H5C 0.9800 . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 C8 1.525(4) . ?
C7 C9 1.531(3) . ?
C7 P2 1.836(3) . ?
C7 H7 1.0000 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 C12 1.519(4) . ?
C10 C11 1.526(4) . ?
C10 P2 1.831(3) . ?
C10 H10 1.0000 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C13 C14 1.517(4) . ?
C13 C15 1.526(4) . ?
C13 P3 1.839(3) . ?
C13 H13 1.0000 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C16 C17 1.530(3) . ?
C16 C18 1.531(3) . ?
C16 P3 1.838(3) . ?
C16 H16 1.0000 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 C20 1.509(4) . ?
C19 C21 1.514(4) . ?
C19 P4 1.827(3) . ?
C19 H19 1.0000 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 C24 1.524(4) . ?
C22 C23 1.530(4) . ?
C22 P4 1.831(3) . ?
C22 H22 1.0000 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C25 C27 1.518(4) . ?
C25 C26 1.526(4) . ?
C25 P5 1.830(3) . ?
C25 H25 1.0000 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
C28 C30 1.528(4) . ?
C28 C29 1.532(4) . ?
C28 P5 1.836(3) . ?
C28 H28 1.0000 . ?
C29 H29A 0.9800 . ?
C29 H29B 0.9800 . ?
C29 H29C 0.9800 . ?
C30 H30A 0.9800 . ?
C30 H30B 0.9800 . ?
C30 H30C 0.9800 . ?
C31 C32 1.527(4) . ?
C31 C33 1.531(4) . ?
C31 P6 1.832(3) . ?
C31 H31 1.0000 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C34 C36' 1.349(8) . ?
C34 C36 1.375(6) . ?
C34 C35 1.525(5) . ?
C34 P6 1.826(3) . ?
C34 H34 1.0000 . ?
C35 H35A 0.9800 . ?
C35 H35B 0.9800 . ?
C35 H35C 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C36' H36D 0.9800 . ?
C36' H36E 0.9800 . ?
C36' H36F 0.9800 . ?
C37 C39 1.521(3) . ?
C37 C38 1.533(4) . ?
C37 P7 1.833(2) . ?
C37 H37 1.0000 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?
C39 H39A 0.9800 . ?
C39 H39B 0.9800 . ?
C39 H39C 0.9800 . ?
C40 C42 1.529(3) . ?
C40 C41 1.530(3) . ?
C40 P7 1.833(2) . ?
C40 H40 1.0000 . ?
C41 H41A 0.9800 . ?
C41 H41B 0.9800 . ?
C41 H41C 0.9800 . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C43 C45 1.518(4) . ?
C43 C44 1.527(4) . ?
C43 P8 1.836(2) . ?
C43 H43 1.0000 . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
C45 H45A 0.9800 . ?
C45 H45B 0.9800 . ?
C45 H45C 0.9800 . ?
C46 C48 1.523(4) . ?
C46 C47 1.537(4) . ?
C46 P8 1.843(3) . ?
C46 H46 1.0000 . ?
C47 H47A 0.9800 . ?
C47 H47B 0.9800 . ?
C47 H47C 0.9800 . ?
C48 H48A 0.9800 . ?
C48 H48B 0.9800 . ?
C48 H48C 0.9800 . ?
O1 P1 1.5494(18) . ?
O1 H01 1.09(4) . ?
O2 P2 1.5451(18) . ?
O2 H01 1.30(4) . ?
O3 P3 1.5432(18) . ?
O3 H02 1.34(5) . ?
O4 P4 1.5544(18) . ?
O4 H02 1.08(5) . ?
O5 P5 1.5552(18) . ?
O5 H03 1.20(5) . ?
O6 P6 1.541(2) . ?
O6 H03 1.21(5) . ?
O7 P7 1.5603(18) . ?
O7 H04 0.99(4) . ?
O8 P8 1.5332(18) . ?
O8 H04 1.44(4) . ?
P6 Pd3 2.2596(7) . ?
P1 Pd1 2.2604(6) . ?
P2 Pd1 2.2596(6) . ?
P3 Pd2 2.2633(6) . ?
P4 Pd2 2.2639(6) . ?
P5 Pd3 2.2575(6) . ?
P7 Pd4 2.2519(6) . ?
P8 Pd4 2.2560(6) . ?
Cl1 Pd2 2.4177(6) . ?
Cl1 Pd1 2.4312(6) . ?
Cl2 Pd1 2.4422(6) . ?
Cl2 Pd2 2.4452(6) . ?
Cl3 Pd4 2.4307(6) . ?
Cl3 Pd3 2.4443(6) . ?
Cl4 Pd3 2.4251(6) . ?
Cl4 Pd4 2.4474(6) . ?
 
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
C3 C1 C2 110.4(2) . . ?
C3 C1 P1 110.16(17) . . ?
C2 C1 P1 110.81(18) . . ?
C3 C1 H1 108.5 . . ?
C2 C1 H1 108.5 . . ?
P1 C1 H1 108.5 . . ?
C1 C2 H2A 109.5 . . ?
C1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
C1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C1 C3 H3A 109.5 . . ?
C1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
C1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C5 C4 C6 112.2(2) . . ?
C5 C4 P1 110.40(18) . . ?
C6 C4 P1 115.59(19) . . ?
C5 C4 H4 106.0 . . ?
C6 C4 H4 106.0 . . ?
P1 C4 H4 106.0 . . ?
C4 C5 H5A 109.5 . . ?
C4 C5 H5B 109.5 . . ?
H5A C5 H5B 109.5 . . ?
C4 C5 H5C 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
C4 C6 H6A 109.5 . . ?
C4 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C4 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C8 C7 C9 110.2(2) . . ?
C8 C7 P2 109.55(17) . . ?
C9 C7 P2 110.64(19) . . ?
C8 C7 H7 108.8 . . ?
C9 C7 H7 108.8 . . ?
P2 C7 H7 108.8 . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C12 C10 C11 111.0(3) . . ?
C12 C10 P2 115.3(2) . . ?
C11 C10 P2 111.58(19) . . ?
C12 C10 H10 106.1 . . ?
C11 C10 H10 106.1 . . ?
P2 C10 H10 106.1 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C14 C13 C15 110.3(2) . . ?
C14 C13 P3 111.24(19) . . ?
C15 C13 P3 117.37(18) . . ?
C14 C13 H13 105.7 . . ?
C15 C13 H13 105.7 . . ?
P3 C13 H13 105.7 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C13 C15 H15A 109.5 . . ?
C13 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C13 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C17 C16 C18 110.1(2) . . ?
C17 C16 P3 108.34(17) . . ?
C18 C16 P3 111.61(19) . . ?
C17 C16 H16 108.9 . . ?
C18 C16 H16 108.9 . . ?
P3 C16 H16 108.9 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C16 C18 H18A 109.5 . . ?
C16 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C16 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C20 C19 C21 112.3(3) . . ?
C20 C19 P4 115.2(2) . . ?
C21 C19 P4 109.43(19) . . ?
C20 C19 H19 106.4 . . ?
C21 C19 H19 106.4 . . ?
P4 C19 H19 106.4 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C21 H21A 109.5 . . ?
C19 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C19 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C24 C22 C23 110.7(2) . . ?
C24 C22 P4 109.98(18) . . ?
C23 C22 P4 110.7(2) . . ?
C24 C22 H22 108.5 . . ?
C23 C22 H22 108.5 . . ?
P4 C22 H22 108.5 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C22 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C27 C25 C26 112.2(3) . . ?
C27 C25 P5 109.60(19) . . ?
C26 C25 P5 116.46(19) . . ?
C27 C25 H25 105.9 . . ?
C26 C25 H25 105.9 . . ?
P5 C25 H25 105.9 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C25 C27 H27A 109.5 . . ?
C25 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C25 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
C30 C28 C29 110.3(2) . . ?
C30 C28 P5 109.97(17) . . ?
C29 C28 P5 111.19(19) . . ?
C30 C28 H28 108.4 . . ?
C29 C28 H28 108.4 . . ?
P5 C28 H28 108.4 . . ?
C28 C29 H29A 109.5 . . ?
C28 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
C28 C29 H29C 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
C28 C30 H30A 109.5 . . ?
C28 C30 H30B 109.5 . . ?
H30A C30 H30B 109.5 . . ?
C28 C30 H30C 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C32 C31 C33 110.5(2) . . ?
C32 C31 P6 110.47(18) . . ?
C33 C31 P6 111.3(2) . . ?
C32 C31 H31 108.2 . . ?
C33 C31 H31 108.2 . . ?
P6 C31 H31 108.2 . . ?
C31 C32 H32A 109.5 . . ?
C31 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C31 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C31 C33 H33A 109.5 . . ?
C31 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C31 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C36' C34 C36 54.1(5) . . ?
C36' C34 C35 112.4(5) . . ?
C36 C34 C35 116.7(4) . . ?
C36' C34 P6 131.0(5) . . ?
C36 C34 P6 121.0(3) . . ?
C35 C34 P6 110.7(2) . . ?
C36' C34 H34 48.2 . . ?
C36 C34 H34 101.4 . . ?
C35 C34 H34 101.4 . . ?
P6 C34 H34 101.4 . . ?
C34 C35 H35A 109.5 . . ?
C34 C35 H35B 109.5 . . ?
H35A C35 H35B 109.5 . . ?
C34 C35 H35C 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C34 C36 H36A 109.5 . . ?
C34 C36 H36B 109.5 . . ?
C34 C36 H36C 109.5 . . ?
C34 C36' H36D 109.5 . . ?
C34 C36' H36E 109.5 . . ?
H36D C36' H36E 109.5 . . ?
C34 C36' H36F 109.5 . . ?
H36D C36' H36F 109.5 . . ?
H36E C36' H36F 109.5 . . ?
C39 C37 C38 110.8(2) . . ?
C39 C37 P7 110.54(17) . . ?
C38 C37 P7 115.45(18) . . ?
C39 C37 H37 106.5 . . ?
C38 C37 H37 106.5 . . ?
P7 C37 H37 106.5 . . ?
C37 C38 H38A 109.5 . . ?
C37 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
C37 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
C37 C39 H39A 109.5 . . ?
C37 C39 H39B 109.5 . . ?
H39A C39 H39B 109.5 . . ?
C37 C39 H39C 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
C42 C40 C41 110.7(2) . . ?
C42 C40 P7 109.02(16) . . ?
C41 C40 P7 112.29(17) . . ?
C42 C40 H40 108.2 . . ?
C41 C40 H40 108.2 . . ?
P7 C40 H40 108.2 . . ?
C40 C41 H41A 109.5 . . ?
C40 C41 H41B 109.5 . . ?
H41A C41 H41B 109.5 . . ?
C40 C41 H41C 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
C40 C42 H42A 109.5 . . ?
C40 C42 H42B 109.5 . . ?
H42A C42 H42B 109.5 . . ?
C40 C42 H42C 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
C45 C43 C44 110.7(2) . . ?
C45 C43 P8 110.59(17) . . ?
C44 C43 P8 114.0(2) . . ?
C45 C43 H43 107.1 . . ?
C44 C43 H43 107.1 . . ?
P8 C43 H43 107.1 . . ?
C43 C44 H44A 109.5 . . ?
C43 C44 H44B 109.5 . . ?
H44A C44 H44B 109.5 . . ?
C43 C44 H44C 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
C43 C45 H45A 109.5 . . ?
C43 C45 H45B 109.5 . . ?
H45A C45 H45B 109.5 . . ?
C43 C45 H45C 109.5 . . ?
H45A C45 H45C 109.5 . . ?
H45B C45 H45C 109.5 . . ?
C48 C46 C47 108.8(2) . . ?
C48 C46 P8 111.58(17) . . ?
C47 C46 P8 111.8(2) . . ?
C48 C46 H46 108.2 . . ?
C47 C46 H46 108.2 . . ?
P8 C46 H46 108.2 . . ?
C46 C47 H47A 109.5 . . ?
C46 C47 H47B 109.5 . . ?
H47A C47 H47B 109.5 . . ?
C46 C47 H47C 109.5 . . ?
H47A C47 H47C 109.5 . . ?
H47B C47 H47C 109.5 . . ?
C46 C48 H48A 109.5 . . ?
C46 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
C46 C48 H48C 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
P1 O1 H01 108(2) . . ?
P2 O2 H01 108.6(17) . . ?
P3 O3 H02 109.7(19) . . ?
P4 O4 H02 109(2) . . ?
P5 O5 H03 112(2) . . ?
P6 O6 H03 112(2) . . ?
P7 O7 H04 105(2) . . ?
P8 O8 H04 106.1(15) . . ?
O6 P6 C34 106.15(18) . . ?
O6 P6 C31 107.08(13) . . ?
C34 P6 C31 106.20(13) . . ?
O6 P6 Pd3 117.13(8) . . ?
C34 P6 Pd3 110.52(15) . . ?
C31 P6 Pd3 109.18(9) . . ?
O1 P1 C4 104.32(11) . . ?
O1 P1 C1 105.69(11) . . ?
C4 P1 C1 107.14(11) . . ?
O1 P1 Pd1 116.96(7) . . ?
C4 P1 Pd1 115.02(9) . . ?
C1 P1 Pd1 107.00(8) . . ?
O2 P2 C10 104.67(12) . . ?
O2 P2 C7 105.86(11) . . ?
C10 P2 C7 106.46(12) . . ?
O2 P2 Pd1 117.49(7) . . ?
C10 P2 Pd1 113.36(9) . . ?
C7 P2 Pd1 108.26(8) . . ?
O3 P3 C16 106.59(11) . . ?
O3 P3 C13 103.16(11) . . ?
C16 P3 C13 105.95(12) . . ?
O3 P3 Pd2 116.88(7) . . ?
C16 P3 Pd2 107.66(8) . . ?
C13 P3 Pd2 115.77(9) . . ?
O4 P4 C19 104.81(11) . . ?
O4 P4 C22 104.72(11) . . ?
C19 P4 C22 106.57(12) . . ?
O4 P4 Pd2 117.17(7) . . ?
C19 P4 Pd2 111.59(9) . . ?
C22 P4 Pd2 111.20(9) . . ?
O5 P5 C25 103.88(12) . . ?
O5 P5 C28 105.29(11) . . ?
C25 P5 C28 106.79(12) . . ?
O5 P5 Pd3 117.01(8) . . ?
C25 P5 Pd3 114.13(9) . . ?
C28 P5 Pd3 108.94(9) . . ?
O7 P7 C40 105.76(11) . . ?
O7 P7 C37 103.50(11) . . ?
C40 P7 C37 107.53(11) . . ?
O7 P7 Pd4 117.06(7) . . ?
C40 P7 Pd4 106.81(8) . . ?
C37 P7 Pd4 115.48(9) . . ?
O8 P8 C43 109.48(11) . . ?
O8 P8 C46 108.20(11) . . ?
C43 P8 C46 106.90(12) . . ?
O8 P8 Pd4 118.04(7) . . ?
C43 P8 Pd4 104.64(8) . . ?
C46 P8 Pd4 109.04(8) . . ?
Pd2 Cl1 Pd1 90.07(2) . . ?
Pd1 Cl2 Pd2 89.16(2) . . ?
Pd4 Cl3 Pd3 89.02(2) . . ?
Pd3 Cl4 Pd4 89.075(19) . . ?
P2 Pd1 P1 92.00(2) . . ?
P2 Pd1 Cl1 176.07(2) . . ?
P1 Pd1 Cl1 91.92(2) . . ?
P2 Pd1 Cl2 93.32(2) . . ?
P1 Pd1 Cl2 170.72(2) . . ?
Cl1 Pd1 Cl2 82.79(2) . . ?
P3 Pd2 P4 92.13(2) . . ?
P3 Pd2 Cl1 91.92(2) . . ?
P4 Pd2 Cl1 175.93(2) . . ?
P3 Pd2 Cl2 174.24(2) . . ?
P4 Pd2 Cl2 92.93(2) . . ?
Cl1 Pd2 Cl2 83.01(2) . . ?
P5 Pd3 P6 92.66(2) . . ?
P5 Pd3 Cl4 174.77(2) . . ?
P6 Pd3 Cl4 90.76(2) . . ?
P5 Pd3 Cl3 92.42(2) . . ?
P6 Pd3 Cl3 174.89(2) . . ?
Cl4 Pd3 Cl3 84.22(2) . . ?
P7 Pd4 P8 92.28(2) . . ?
P7 Pd4 Cl3 174.22(2) . . ?
P8 Pd4 Cl3 90.48(2) . . ?
P7 Pd4 Cl4 93.46(2) . . ?
P8 Pd4 Cl4 173.71(2) . . ?
Cl3 Pd4 Cl4 84.03(2) . . ?
 
_diffrn_measured_fraction_theta_max    0.994
_diffrn_reflns_theta_full              27.50
_diffrn_measured_fraction_theta_full   0.994
_refine_diff_density_max    0.768
_refine_diff_density_min   -1.003
_refine_diff_density_rms    0.096
