#------------------------------------------------------------------------------
#$Date: 2010-01-30 15:59:17 +0200 (Sat, 30 Jan 2010) $
#$Revision: 966 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/2008342.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_2008342
_journal_name_full 'Acta Crystallographica Section C'
_journal_year  1999
_journal_volume 55
_journal_page_first  541
_journal_page_last  543
_publ_section_title
;
Chloro(diethyl dithiophosphato-S,S')(triphenylphosphine-P)palladium(II)
;
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_[local]_cod_cif_authors_sg_H-M  'P 21/a'
loop_
_publ_author_name
  'Panneerselvam, Kaliyamoorthy'
  'Lu, Tian-Huey'
  'Tung, Shu-Fang'
  'Narayan, Sanjay'
  'Jain, Vimal K.'
_chemical_formula_moiety  'C22 H25 Cl1 O2 P2 Pd1 S2'
_chemical_formula_sum            'C22 H25 Cl O2 P2 Pd S2'
_[local]_cod_chemical_formula_sum_orig 'C22 H25 Cl1 O2 P2 Pd1 S2'
_chemical_formula_iupac  '[Pd Cl (C4 H10 O2 P S2) (C18 H15 P)]'
_chemical_formula_weight  589.36
_chemical_melting_point  393
_symmetry_cell_setting  monoclinic
loop_
_symmetry_equiv_pos_as_xyz
  'x, y, z'
  '1/2-x, 1/2+y, -z'
  '-x, -y, -z'
  '1/2+x, 1/2-y, z'
_cell_length_a  18.178(3)
_cell_length_b  9.233(4)
_cell_length_c  30.904(7)
_cell_angle_alpha  90.00
_cell_angle_beta  101.300(10)
_cell_angle_gamma  90.00
_cell_volume  5086(3)
_cell_formula_units_Z  8
_cell_measurement_temperature  293(2)
_exptl_crystal_density_diffrn  1.539
_diffrn_ambient_temperature  293(2)
_refine_ls_R_factor_obs  0.053
_refine_ls_wR_factor_obs  0.159
loop_
_atom_site_label
_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_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_disorder_group
_atom_site_type_symbol
  Pd1A 0.40733(2) 0.05118(5) 0.11245(2) 0.0401(2) Uani d . 1 . Pd
  S1A 0.46457(10) 0.1585(2) 0.05686(7) 0.0627(5) Uani d . 1 . S
  S2A 0.29751(9) 0.1395(2) 0.07031(6) 0.0492(4) Uani d . 1 . S
  Cl1A 0.52085(11) -0.0380(3) 0.14939(8) 0.0733(6) Uani d . 1 . Cl
  P1A 0.35054(9) -0.0556(2) 0.16319(6) 0.0407(4) Uani d . 1 . P
  P2A 0.36009(10) 0.2045(2) 0.02735(6) 0.0462(4) Uani d . 1 . P
  O1A 0.3440(3) 0.3691(5) 0.0174(2) 0.0555(12) Uani d . 1 . O
  O2A 0.3367(3) 0.1380(6) -0.0200(2) 0.0604(13) Uani d . 1 . O
  C1A 0.3787(5) 0.4443(9) -0.0155(3) 0.072(2) Uani d . 1 . C
  H1A 0.3446(5) 0.4456(9) -0.0438(3) 0.120 Uiso calc R 1 . H
  H2A 0.4244(5) 0.3952(9) -0.0188(3) 0.120 Uiso calc R 1 . H
  C2A 0.3958(6) 0.5949(11) 0.0006(4) 0.095(3) Uani d . 1 . C
  H3A 0.4188(6) 0.6469(11) -0.0201(4) 0.120 Uiso calc R 1 . H
  H4A 0.4295(6) 0.5923(11) 0.0287(4) 0.120 Uiso calc R 1 . H
  H5A 0.3501(6) 0.6426(11) 0.0037(4) 0.120 Uiso calc R 1 . H
  C3A 0.3466(6) -0.0180(9) -0.0274(3) 0.069(2) Uani d . 1 . C
  H6A 0.3959(6) -0.0494(9) -0.0123(3) 0.120 Uiso calc R 1 . H
  H7A 0.3090(6) -0.0736(9) -0.0163(3) 0.120 Uiso calc R 1 . H
  C4A 0.3384(5) -0.0391(10) -0.0750(3) 0.079(3) Uani d . 1 . C
  H8A 0.3445(5) -0.1400(10) -0.0811(3) 0.120 Uiso calc R 1 . H
  H9A 0.3760(5) 0.0162(10) -0.0856(3) 0.120 Uiso calc R 1 . H
  H10A 0.2895(5) -0.0076(10) -0.0896(3) 0.120 Uiso calc R 1 . H
  C5A 0.3671(4) -0.2487(7) 0.1625(2) 0.0411(13) Uani d . 1 . C
  C6A 0.3924(4) -0.3308(8) 0.2001(3) 0.055(2) Uani d . 1 . C
  H11A 0.4004(4) -0.2862(8) 0.2276(3) 0.080 Uiso calc R 1 . H
  C7A 0.4059(5) -0.4768(9) 0.1975(3) 0.070(2) Uani d . 1 . C
  H12A 0.4242(5) -0.5295(9) 0.2229(3) 0.080 Uiso calc R 1 . H
  C8A 0.3923(5) -0.5446(8) 0.1572(3) 0.069(2) Uani d . 1 . C
  H13A 0.3999(5) -0.6438(8) 0.1555(3) 0.080 Uiso calc R 1 . H
  C9A 0.3675(5) -0.4663(9) 0.1197(3) 0.070(2) Uani d . 1 . C
  H14A 0.3586(5) -0.5131(9) 0.0925(3) 0.080 Uiso calc R 1 . H
  C10A 0.3554(5) -0.3202(8) 0.1214(3) 0.065(2) Uani d . 1 . C
  H15A 0.3395(5) -0.2682(8) 0.0955(3) 0.080 Uiso calc R 1 . H
  C11A 0.3810(4) 0.0051(7) 0.2200(2) 0.0455(15) Uani d . 1 . C
  C12A 0.3436(5) -0.0428(9) 0.2518(3) 0.066(2) Uani d . 1 . C
  H16A 0.3016(5) -0.1020(9) 0.2445(3) 0.080 Uiso calc R 1 . H
  C13A 0.3707(6) 0.0005(12) 0.2957(3) 0.081(3) Uani d . 1 . C
  H17A 0.3474(6) -0.0338(12) 0.3179(3) 0.080 Uiso calc R 1 . H
  C14A 0.4295(6) 0.0905(13) 0.3060(3) 0.089(3) Uani d . 1 . C
  H18A 0.4455(6) 0.1189(13) 0.3352(3) 0.080 Uiso calc R 1 . H
  C15A 0.4657(6) 0.1405(11) 0.2753(4) 0.087(3) Uani d . 1 . C
  H19A 0.5065(6) 0.2024(11) 0.2831(4) 0.080 Uiso calc R 1 . H
  C16A 0.4418(4) 0.0992(8) 0.2315(3) 0.063(2) Uani d . 1 . C
  H20A 0.4663(4) 0.1342(8) 0.2100(3) 0.080 Uiso calc R 1 . H
  C17A 0.2484(4) -0.0329(7) 0.1530(2) 0.0458(15) Uani d . 1 . C
  C18A 0.1987(4) -0.1476(8) 0.1423(3) 0.058(2) Uani d . 1 . C
  H21A 0.2169(4) -0.2412(8) 0.1408(3) 0.080 Uiso calc R 1 . H
  C19A 0.1220(5) -0.1224(11) 0.1339(3) 0.075(2) Uani d . 1 . C
  H22A 0.0887(5) -0.1988(11) 0.1261(3) 0.080 Uiso calc R 1 . H
  C20A 0.0952(5) 0.0167(12) 0.1370(3) 0.076(3) Uani d . 1 . C
  H23A 0.0439(5) 0.0340(12) 0.1319(3) 0.080 Uiso calc R 1 . H
  C21A 0.1441(5) 0.1272(10) 0.1476(3) 0.067(2) Uani d . 1 . C
  H24A 0.1257(5) 0.2202(10) 0.1500(3) 0.080 Uiso calc R 1 . H
  C22A 0.2198(4) 0.1055(8) 0.1550(3) 0.055(2) Uani d . 1 . C
  H25A 0.2523(4) 0.1839(8) 0.1613(3) 0.080 Uiso calc R 1 . H
  Pd1B 0.07203(3) 0.17806(5) 0.62209(2) 0.0441(2) Uani d . 1 . Pd
  S1B 0.19899(11) 0.1095(3) 0.62827(9) 0.0793(7) Uani d . 1 . S
  S2B 0.06927(11) -0.0074(3) 0.67195(7) 0.0668(6) Uani d . 1 . S
  Cl1B 0.08875(15) 0.3442(3) 0.56925(10) 0.0881(8) Uani d . 1 . Cl
  P1B -0.05261(9) 0.2254(2) 0.61608(5) 0.0384(4) Uani d . 1 . P
  P2B 0.17132(11) -0.0596(3) 0.66102(7) 0.0620(5) Uani d . 1 . P
  O1B 0.1744(4) -0.2072(7) 0.6370(2) 0.079(2) Uani d . 1 . O
  O2B 0.2298(3) -0.0971(8) 0.7037(2) 0.088(2) Uani d . 1 . O
  C1B 0.1269(9) -0.2294(15) 0.5923(5) 0.121(5) Uani d . 1 . C
  H1B 0.0819(9) -0.2829(15) 0.5945(5) 0.120 Uiso calc R 1 . H
  H2B 0.1123(9) -0.1368(15) 0.5784(5) 0.120 Uiso calc R 1 . H
  C2B 0.1690(9) -0.3057(16) 0.5682(6) 0.157(7) Uani d . 1 . C
  H3B 0.1403(9) -0.3221(16) 0.5391(6) 0.120 Uiso calc R 1 . H
  H4B 0.1829(9) -0.3970(16) 0.5823(6) 0.120 Uiso calc R 1 . H
  H5B 0.2134(9) -0.2517(16) 0.5664(6) 0.120 Uiso calc R 1 . H
  C3B 0.2557(8) 0.011(2) 0.7364(5) 0.145(6) Uani d . 1 . C
  H6B 0.2778(8) 0.091(2)  0.7229(5) 0.120 Uiso calc R 1 . H
  H7B 0.2136(8) 0.048(2)  0.7480(5) 0.120 Uiso calc R 1 . H
  C4B 0.3077(11) -0.046(2) 0.7699(5) 0.204(10) Uani d . 1 . C
  H8B 0.3248(11) 0.028(2)  0.7914(5) 0.120 Uiso calc R 1 . H
  H9B 0.3495(11) -0.082(2)  0.7584(5) 0.120 Uiso calc R 1 . H
  H10B 0.2856(11) -0.124(2)  0.7836(5) 0.120 Uiso calc R 1 . H
  C5B -0.0824(3) 0.4136(7) 0.6075(2) 0.0392(13) Uani d . 1 . C
  C6B -0.0765(4) 0.4776(8) 0.5679(2) 0.055(2) Uani d . 1 . C
  H11B -0.0600(4) 0.4236(8) 0.5462(2) 0.080 Uiso calc R 1 . H
  C7B -0.0953(5) 0.6228(9) 0.5603(3) 0.064(2) Uani d . 1 . C
  H12B -0.0904(5) 0.6667(9) 0.5340(3) 0.080 Uiso calc R 1 . H
  C8B -0.1215(5) 0.7018(8) 0.5924(3) 0.068(2) Uani d . 1 . C
  H13B -0.1337(5) 0.7991(8) 0.5876(3) 0.080 Uiso calc R 1 . H
  C9B -0.1294(5) 0.6381(8) 0.6303(3) 0.067(2) Uani d . 1 . C
  H14B -0.1482(5) 0.6919(8) 0.6512(3) 0.080 Uiso calc R 1 . H
  C10B -0.1100(4) 0.4942(8) 0.6392(2) 0.049(2) Uani d . 1 . C
  H15B -0.1154(4) 0.4521(8) 0.6658(2) 0.080 Uiso calc R 1 . H
  C11B -0.1090(3) 0.1336(6) 0.5689(2) 0.0401(13) Uani d . 1 . C
  C12B -0.0751(4) 0.0430(7) 0.5430(2) 0.051(2) Uani d . 1 . C
  H16B -0.0235(4) 0.0284(7) 0.5496(2) 0.080 Uiso calc R 1 . H
  C13B -0.1196(6) -0.0267(8) 0.5066(3) 0.065(2) Uani d . 1 . C
  H17B -0.0974(6) -0.0870(8) 0.4887(3) 0.080 Uiso calc R 1 . H
  C14B -0.1951(6) -0.0057(10) 0.4975(3) 0.071(2) Uani d . 1 . C
  H18B -0.2245(6) -0.0545(10) 0.4740(3) 0.080 Uiso calc R 1 . H
  C15B -0.2283(5) 0.0861(10) 0.5226(3) 0.071(2) Uani d . 1 . C
  H19B -0.2798(5) 0.1017(10) 0.5154(3) 0.080 Uiso calc R 1 . H
  C16B -0.1858(4) 0.1557(8) 0.5584(2) 0.052(2) Uani d . 1 . C
  H20B -0.2087(4) 0.2176(8) 0.5755(2) 0.080 Uiso calc R 1 . H
  C17B -0.0879(4) 0.1627(7) 0.6643(2) 0.0448(15) Uani d . 1 . C
  C18B -0.1416(4) 0.0561(8) 0.6621(3) 0.055(2) Uani d . 1 . C
  H21B -0.1636(4) 0.0169(8) 0.6349(3) 0.080 Uiso calc R 1 . H
  C19B -0.1632(6) 0.0063(11) 0.7007(3) 0.077(2) Uani d . 1 . C
  H22B -0.1975(6) -0.0691(11) 0.6992(3) 0.080 Uiso calc R 1 . H
  C20B -0.1341(6) 0.0682(11) 0.7403(4) 0.083(3) Uani d . 1 . C
  H23B -0.1500(6) 0.0376(11) 0.7657(4) 0.080 Uiso calc R 1 . H
  C21B -0.0810(5) 0.1760(11) 0.7430(3) 0.071(2) Uani d . 1 . C
  H24B -0.0613(5) 0.2182(11) 0.7701(3) 0.080 Uiso calc R 1 . H
  C22B -0.0572(4) 0.2213(9) 0.7056(2) 0.058(2) Uani d . 1 . C
  H25B -0.0201(4) 0.2918(9) 0.7079(2) 0.080 Uiso calc R 1 . H
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
  Pd1A 0.0362(3) 0.0393(3) 0.0452(3) 0.0007(2) 0.0090(2) 0.0030(2)
  S1A 0.0426(9) 0.0790(13) 0.0697(13) 0.0030(9) 0.0191(9) 0.0224(10)
  S2A 0.0388(8) 0.0593(10) 0.0499(9) 0.0017(7) 0.0102(7) 0.0109(8)
  Cl1A 0.0459(10) 0.095(2) 0.0780(14) 0.0190(9) 0.0082(9) 0.0196(11)
  P1A 0.0450(9) 0.0344(8) 0.0433(9) 0.0008(6) 0.0102(7) 0.0003(6)
  P2A 0.0493(9) 0.0419(9) 0.0496(10) 0.0043(7) 0.0153(8) 0.0047(7)
  O1A 0.069(3) 0.044(3) 0.059(3) 0.005(2) 0.025(3) 0.005(2)
  O2A 0.080(3) 0.050(3) 0.053(3) 0.009(2) 0.017(3) -0.006(2)
  C1A 0.085(6) 0.059(5) 0.078(6) 0.013(4) 0.036(5) 0.025(4)
  C2A 0.095(7) 0.071(6) 0.123(9) -0.006(5) 0.033(7) 0.036(6)
  C3A 0.100(6) 0.045(4) 0.067(5) 0.000(4) 0.028(5) -0.005(4)
  C4A 0.083(6) 0.075(6) 0.079(6) 0.004(5) 0.012(5) -0.026(5)
  C5A 0.051(3) 0.036(3) 0.037(3) 0.002(3) 0.010(3) -0.002(3)
  C6A 0.067(5) 0.043(4) 0.053(4) 0.006(3) 0.004(4) -0.004(3)
  C7A 0.079(6) 0.045(4) 0.084(6) 0.011(4) 0.012(5) 0.006(4)
  C8A 0.073(5) 0.034(4) 0.104(7) 0.002(3) 0.027(5) -0.011(4)
  C9A 0.098(7) 0.052(5) 0.059(5) 0.001(4) 0.017(5) -0.023(4)
  C10A 0.101(6) 0.048(4) 0.047(4) 0.002(4) 0.016(4) -0.008(3)
  C11A 0.054(4) 0.044(3) 0.036(3) 0.010(3) 0.001(3) -0.008(3)
  C12A 0.069(5) 0.072(5) 0.062(5) 0.016(4) 0.024(4) -0.008(4)
  C13A 0.097(7) 0.103(7) 0.045(4) 0.038(6) 0.020(5) 0.000(5)
  C14A 0.080(7) 0.118(9) 0.061(6) 0.036(6) -0.009(5) -0.041(6)
  C15A 0.076(6) 0.070(6) 0.102(8) 0.016(5) -0.014(6) -0.045(6)
  C16A 0.066(5) 0.046(4) 0.070(5) 0.004(4) -0.002(4) -0.008(4)
  C17A 0.046(3) 0.046(4) 0.047(4) -0.003(3) 0.016(3) -0.001(3)
  C18A 0.059(4) 0.051(4) 0.064(5) -0.011(3) 0.010(4) -0.002(3)
  C19A 0.054(5) 0.090(7) 0.081(6) -0.022(5) 0.017(4) 0.002(5)
  C20A 0.055(5) 0.111(8) 0.065(5) 0.002(5) 0.020(4) 0.020(5)
  C21A 0.063(5) 0.078(6) 0.066(5) 0.021(4) 0.028(4) 0.017(4)
  C22A 0.055(4) 0.050(4) 0.065(5) 0.007(3) 0.021(4) 0.012(3)
  Pd1B 0.0415(3) 0.0410(3) 0.0515(3) -0.0013(2) 0.0137(2) 0.0046(2)
  S1B 0.0451(10) 0.083(2) 0.115(2) 0.0048(10) 0.0284(11) 0.0241(14)
  S2B 0.0555(11) 0.0774(13) 0.0721(13) 0.0182(10) 0.0240(10) 0.0340(11)
  Cl1B 0.099(2) 0.0656(13) 0.116(2) 0.0125(11) 0.060(2) 0.0402(13)
  P1B 0.0418(8) 0.0329(8) 0.0414(8) 0.0011(6) 0.0102(7) 0.0040(6)
  P2B 0.0491(10) 0.0745(14) 0.0620(12) 0.0130(9) 0.0096(9) 0.0113(10)
  O1B 0.077(4) 0.076(4) 0.087(5) 0.007(3) 0.026(3) 0.000(3)
  O2B 0.070(4) 0.107(5) 0.081(4) 0.031(4) 0.001(3) 0.013(4)
  C1B 0.161(13) 0.103(9) 0.113(10) 0.016(9) 0.058(10) 0.020(8)
  C2B 0.174(16) 0.098(11) 0.22(2)  -0.029(10) 0.076(14) 0.012(11)
  C3B 0.105(10) 0.224(19) 0.100(10) 0.009(11) 0.008(8) -0.035(12)
  C4B 0.218(19) 0.22(2)  0.126(13) -0.030(16) -0.092(14) 0.013(13)
  C5B 0.036(3) 0.035(3) 0.046(3) 0.000(2) 0.006(3) -0.005(3)
  C6B 0.072(5) 0.043(4) 0.050(4) 0.005(3) 0.016(3) 0.005(3)
  C7B 0.076(5) 0.058(5) 0.056(4) 0.007(4) 0.007(4) 0.023(4)
  C8B 0.072(5) 0.038(4) 0.096(7) 0.008(3) 0.017(5) 0.011(4)
  C9B 0.078(5) 0.042(4) 0.085(6) 0.009(4) 0.024(5) -0.013(4)
  C10B 0.057(4) 0.045(4) 0.047(4) -0.005(3) 0.013(3) -0.004(3)
  C11B 0.050(3) 0.034(3) 0.037(3) -0.006(3) 0.012(3) -0.001(2)
  C12B 0.068(4) 0.040(4) 0.049(4) -0.004(3) 0.023(3) -0.001(3)
  C13B 0.108(7) 0.045(4) 0.047(4) -0.014(4) 0.029(4) -0.012(3)
  C14B 0.105(7) 0.059(5) 0.044(4) -0.032(5) 0.001(4) -0.008(4)
  C15B 0.065(5) 0.076(6) 0.067(5) -0.016(4) 0.000(4) 0.004(5)
  C16B 0.053(4) 0.057(4) 0.043(4) -0.004(3) 0.002(3) -0.005(3)
  C17B 0.042(3) 0.043(3) 0.051(4) 0.010(3) 0.012(3) 0.012(3)
  C18B 0.065(4) 0.052(4) 0.051(4) -0.005(3) 0.020(3) 0.002(3)
  C19B 0.092(6) 0.071(5) 0.078(6) -0.010(5) 0.045(5) 0.016(5)
  C20B 0.084(6) 0.095(7) 0.083(7) 0.010(5) 0.048(5) 0.026(6)
  C21B 0.064(5) 0.109(7) 0.041(4) 0.013(5) 0.013(4) 0.008(4)
  C22B 0.053(4) 0.067(5) 0.054(4) 0.003(4) 0.011(3) 0.004(4)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
  Pd1A P1A . 2.265(2) yes
  Pd1A Cl1A . 2.306(2) yes
  Pd1A S2A . 2.308(2) yes
  Pd1A S1A . 2.391(2) yes
  S1A P2A . 1.985(3) yes
  S2A P2A . 2.002(2) yes
  P1A C5A . 1.809(6) no
  P1A C11A . 1.823(6) no
  P1A C17A . 1.834(7) no
  P2A O1A . 1.567(5) yes
  P2A O2A . 1.568(5) yes
  O1A C1A . 1.470(9) yes
  O2A C3A . 1.474(9) yes
  C1A C2A . 1.489(14) no
  C1A H1A . 0.97 no
  C1A H2A . 0.97 no
  C2A H3A . 0.96 no
  C2A H4A . 0.96 no
  C2A H5A . 0.96 no
  C3A C4A . 1.462(12) no
  C3A H6A . 0.97 no
  C3A H7A . 0.97 no
  C4A H8A . 0.96 no
  C4A H9A . 0.96 no
  C4A H10A . 0.96 no
  C5A C6A . 1.388(10) no
  C5A C10A . 1.411(9) no
  C6A C7A . 1.376(10) no
  C6A H11A . 0.93 no
  C7A C8A . 1.371(12) no
  C7A H12A . 0.93 no
  C8A C9A . 1.366(12) no
  C8A H13A . 0.93 no
  C9A C10A . 1.369(11) no
  C9A H14A . 0.93 no
  C10A H15A . 0.93 no
  C11A C12A . 1.373(11) no
  C11A C16A . 1.396(10) no
  C12A C13A . 1.406(12) no
  C12A H16A . 0.93 no
  C13A C14A . 1.342(15) no
  C13A H17A . 0.93 no
  C14A C15A . 1.34(2) no
  C14A H18A . 0.93 no
  C15A C16A . 1.389(13) no
  C15A H19A . 0.93 no
  C16A H20A . 0.93 no
  C17A C22A . 1.385(10) no
  C17A C18A . 1.389(10) no
  C18A C19A . 1.388(11) no
  C18A H21A . 0.93 no
  C19A C20A . 1.384(14) no
  C19A H22A . 0.93 no
  C20A C21A . 1.350(14) no
  C20A H23A . 0.93 no
  C21A C22A . 1.366(10) no
  C21A H24A . 0.93 no
  C22A H25A . 0.93 no
  Pd1B P1B . 2.279(2) yes
  Pd1B Cl1B . 2.304(2) yes
  Pd1B S2B . 2.311(2) yes
  Pd1B S1B . 2.364(2) yes
  S1B P2B . 1.979(3) yes
  S2B P2B . 2.009(3) yes
  P1B C11B . 1.820(6) no
  P1B C5B . 1.824(6) no
  P1B C17B . 1.828(7) no
  P2B O2B . 1.562(6) yes
  P2B O1B . 1.557(7) yes
  O1B C1B . 1.49(2) yes
  O2B C3B . 1.43(2) yes
  C1B C2B . 1.36(2) no
  C1B H1B . 0.97 no
  C1B H2B . 0.97 no
  C2B H3B . 0.96 no
  C2B H4B . 0.96 no
  C2B H5B . 0.96 no
  C3B C4B . 1.36(2) no
  C3B H6B . 0.97 no
  C3B H7B . 0.97 no
  C4B H8B . 0.96 no
  C4B H9B . 0.96 no
  C4B H10B . 0.96 no
  C5B C6B . 1.383(9) no
  C5B C10B . 1.401(9) no
  C6B C7B . 1.391(11) no
  C6B H11B . 0.93 no
  C7B C8B . 1.388(12) no
  C7B H12B . 0.93 no
  C8B C9B . 1.344(13) no
  C8B H13B . 0.93 no
  C9B C10B . 1.388(11) no
  C9B H14B . 0.93 no
  C10B H15B . 0.93 no
  C11B C16B . 1.384(9) no
  C11B C12B . 1.382(9) no
  C12B C13B . 1.407(11) no
  C12B H16B . 0.93 no
  C13B C14B . 1.361(13) no
  C13B H17B . 0.93 no
  C14B C15B . 1.365(13) no
  C14B H18B . 0.93 no
  C15B C16B . 1.379(11) no
  C15B H19B . 0.93 no
  C16B H20B . 0.93 no
  C17B C18B . 1.378(10) no
  C17B C22B . 1.399(10) no
  C18B C19B . 1.406(11) no
  C18B H21B . 0.93 no
  C19B C20B . 1.360(14) no
  C19B H22B . 0.93 no
  C20B C21B . 1.377(13) no
  C20B H23B . 0.93 no
  C21B C22B . 1.377(11) no
  C21B H24B . 0.93 no
  C22B H25B . 0.93 no
_cod_database_code 2008342