#------------------------------------------------------------------------------
#$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $
#$Revision: 14 $
#$URL: svn://www.crystallography.net/cod/cif/8/8000008.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_8000008
_publ_section_title
;
 Alkylation of Nonbridging Thiolato Groups in an S-bridged
 CoIIIPdIICoIII Trinuclear Complex: Control of Geometrical Isomerism by
 Tuning Trans Influence Due to Sulfur Donors
;
_chemical_formula_sum 'C14 H56 Cl4 Co2 N6 O7 Pd S6'
loop_
_publ_author_name
 'Yu Chikamoto'
 'Masakazu Hirotsu'
 'Tatsuya Kawamoto'
 'Takumi Konno'
_journal_name_full             'Chemistry Letters'
_journal_year                  2005
_journal_volume                34
_journal_page_first            362
_cell_measurement_temperature  296(2)
_diffrn_ambient_temperature    296(2)
_cell_length_a       16.155(2)
_cell_length_b       15.088(3)
_cell_length_c       17.174(2)
_cell_angle_alpha    90.00
_cell_angle_beta     112.312(9)
_cell_angle_gamma    90.00
_cell_volume          3872.69
_symmetry_space_group_name_H-M    'P 21'
loop_
_symmetry_equiv_pos_as_xyz
 'x, y, z'
 '-x, y+1/2, -z'
loop_
_atom_site_label
_atom_site_symmetry_multiplicity
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
Pd1 1 0.00001(18) 0.4925(4) 0.24958(18) 1 0.0274(4) Uani d .
Pd2 1 0.50035(18) 0.4943(4) 0.25036(19) 1 0.0281(4) Uani d .
Co1 1 -0.1807(3) 0.4830(5) 0.0688(2) 1 0.0251(9) Uani d .
Co2 1 0.1798(3) 0.4835(5) 0.4308(3) 1 0.0255(9) Uani d .
Co3 1 0.3207(3) 0.5021(5) 0.0695(3) 1 0.0305(11) Uani d .
Co4 1 0.6801(3) 0.5027(5) 0.4318(3) 1 0.0309(11) Uani d .
Cl1 1 0.2738(7) 0.7785(8) 0.3744(6) 1 0.069(3) Uani d .
Cl2 1 -0.2750(7) 0.7765(7) 0.1236(6) 1 0.071(3) Uani d .
Cl3 1 0.2273(8) 0.2124(8) 0.1234(6) 1 0.075(3) Uani d .
Cl4 1 0.7717(6) 0.2147(6) 0.3773(6) 1 0.056(3) Uani d .
Cl5 1 0.1338(7) 0.7523(7) 0.0518(7) 1 0.057(3) Uani d .
Cl6 1 0.6314(6) 0.7354(7) 0.5518(6) 1 0.048(2) Uani d .
Cl7 1 0.3680(6) 0.7356(7) -0.0522(6) 1 0.055(3) Uani d .
Cl8 1 -0.1323(6) 0.7530(7) 0.4487(6) 1 0.054(3) Uani d .
S1 1 -0.0318(5) 0.4813(7) 0.1055(5) 1 0.0297(18) Uani d .
S2 1 -0.1545(5) 0.4976(7) 0.2079(5) 1 0.0322(19) Uani d .
S3 1 -0.3337(5) 0.4810(7) 0.0227(5) 1 0.037(2) Uani d .
S4 1 0.0295(5) 0.4810(6) 0.3914(5) 1 0.0279(18) Uani d .
S5 1 0.1552(5) 0.4989(8) 0.2922(5) 1 0.0314(19) Uani d .
S6 1 0.3318(5) 0.4820(7) 0.4755(5) 1 0.035(2) Uani d .
S7 1 0.4715(5) 0.5070(7) 0.1082(5) 1 0.036(2) Uani d .
S8 1 0.3458(5) 0.4887(8) 0.2069(5) 1 0.034(2) Uani d .
S9 1 0.1680(6) 0.5033(8) 0.0261(6) 1 0.049(3) Uani d .
S10 1 0.5306(5) 0.5078(7) 0.3932(5) 1 0.032(2) Uani d .
S11 1 0.6560(5) 0.4862(7) 0.2943(5) 1 0.0304(18) Uani d .
S12 1 0.8345(5) 0.5041(7) 0.4746(6) 1 0.042(2) Uani d .
O1 1 0.0290 0.2434 0.1227 1 0.077(8) Uiso d .
O2 1 0.4138 0.4649 -0.1437 1 0.078(9) Uiso d .
O3 1 0.4189 0.9649 0.3628 1 0.054(5) Uiso d .
O4 1 -0.4640 0.7762 0.1335 1 0.077(6) Uiso d .
O5 1 -0.0195 0.1342 0.2542 0.50 0.031(5) Uiso d P
O6 1 -0.6372 0.1293 0.2886 0.50 0.062(8) Uiso d P
O7 1 -0.3876 0.2510 0.2233 0.50 0.043(7) Uiso d P
O8 1 -0.0279 0.2455 0.3803 1 0.082(9) Uiso d .
O9 1 -0.5355 0.7632 0.3693 1 0.101(10) Uiso d .
O10 1 -0.1021 0.8360 0.2878 0.50 0.039(5) Uiso d P
O11 1 0.1242 0.8595 0.2165 0.50 0.056(8) Uiso d P
O12 1 0.4685 0.0845 0.2581 0.50 0.069(11) Uiso d P
O13 1 0.0934 0.0216 0.1526 1 0.112(10) Uiso d .
O14 1 0.9161 0.0052 0.3470 1 0.082(5) Uiso d .
O15 1 0.4857 0.8468 0.2559 1 0.097(6) Uiso d .
O16 1 -0.4707 0.0885 0.2326 0.50 0.095(15) Uiso d P
O17 1 -0.0046 0.9102 0.2526 0.50 0.126(11) Uiso d P
O18 1 0.0960 0.7829 0.2160 0.50 0.072(8) Uiso d P
O19 1 -0.6039 0.2420 0.2781 0.50 0.050(8) Uiso d P
N1 1 -0.1726(12) 0.6084(16) 0.0529(14) 1 0.044(7) Uani d .
H1A 1 -0.1896 0.6186 -0.0026 1 0.052 Uiso calc R
H1B 1 -0.2124 0.6357 0.0698 1 0.052 Uiso calc R
N2 1 -0.1820(14) 0.3549(15) 0.0887(11) 1 0.031(6) Uani d .
H2A 1 -0.2389 0.3363 0.0633 1 0.037 Uiso calc R
H2B 1 -0.1502 0.3286 0.0621 1 0.037 Uiso calc R
N3 1 -0.1926(17) 0.4622(19) -0.0441(16) 1 0.055(8) Uani d .
H3A 1 -0.1611 0.5033 -0.0591 1 0.066 Uiso calc R
H3B 1 -0.1694 0.4087 -0.0474 1 0.066 Uiso calc R
N4 1 0.1707(16) 0.6132(15) 0.4448(16) 1 0.037(7) Uani d .
H4A 1 0.1923 0.6259 0.5001 1 0.045 Uiso calc R
H4B 1 0.2055 0.6410 0.4221 1 0.045 Uiso calc R
N5 1 0.1809(15) 0.3524(14) 0.4108(15) 1 0.038(7) Uani d .
H5A 1 0.2377 0.3334 0.4359 1 0.046 Uiso calc R
H5B 1 0.1488 0.3260 0.4372 1 0.046 Uiso calc R
N6 1 0.1954(15) 0.4595(16) 0.5498(12) 1 0.030(6) Uani d .
H6A 1 0.1579 0.4943 0.5638 1 0.036 Uiso calc R
H6B 1 0.1812 0.4027 0.5547 1 0.036 Uiso calc R
N7 1 0.3121(17) 0.6321(17) 0.0848(15) 1 0.040(7) Uani d .
H7A 1 0.3408 0.6611 0.0567 1 0.048 Uiso calc R
H7B 1 0.2542 0.6486 0.0629 1 0.048 Uiso calc R
N8 1 0.3230(16) 0.3718(15) 0.0588(15) 1 0.038(6) Uani d .
H8A 1 0.2896 0.3473 0.0848 1 0.045 Uiso calc R
H8B 1 0.2982 0.3570 0.0040 1 0.045 Uiso calc R
N9 1 0.3025(11) 0.5249(16) -0.0515(12) 1 0.036(7) Uani d .
H9A 1 0.3235 0.5796 -0.0542 1 0.044 Uiso calc R
H9B 1 0.3373 0.4864 -0.0653 1 0.044 Uiso calc R
N10 1 0.6700(16) 0.3715(14) 0.4412(15) 1 0.031(6) Uani d .
H10A 1 0.7027 0.3456 0.4152 1 0.037 Uiso calc R
H10B 1 0.6951 0.3569 0.4960 1 0.037 Uiso calc R
N11 1 0.6846(15) 0.6352(16) 0.4122(16) 1 0.033(7) Uani d .
H11A 1 0.6531 0.6637 0.4380 1 0.040 Uiso calc R
H11B 1 0.7417 0.6537 0.4358 1 0.040 Uiso calc R
N12 1 0.6984(16) 0.5241(15) 0.5544(13) 1 0.039(7) Uani d .
H12A 1 0.6768 0.5783 0.5576 1 0.047 Uiso calc R
H12B 1 0.6641 0.4848 0.5679 1 0.047 Uiso calc R
C1 1 -0.0183(18) 0.5946(18) 0.0763(15) 1 0.045(9) Uani d .
H1C 1 0.0425 0.6146 0.1070 1 0.054 Uiso calc R
H1D 1 -0.0305 0.5980 0.0165 1 0.054 Uiso calc R
C2 1 -0.0827(18) 0.6516(17) 0.097(2) 1 0.047(9) Uani d .
H2C 1 -0.0826 0.7116 0.0770 1 0.056 Uiso calc R
H2D 1 -0.0675 0.6532 0.1576 1 0.056 Uiso calc R
C3 1 -0.177(2) 0.3861(19) 0.234(2) 1 0.045(9) Uani d .
H3C 1 -0.1404 0.3723 0.2922 1 0.054 Uiso calc R
H3D 1 -0.2393 0.3791 0.2251 1 0.054 Uiso calc R
C4 1 -0.1503(17) 0.323(2) 0.1706(18) 1 0.041(8) Uani d .
H4C 1 -0.0857 0.3181 0.1910 1 0.049 Uiso calc R
H4D 1 -0.1744 0.2643 0.1708 1 0.049 Uiso calc R
C5 1 -0.3618(19) 0.435(3) -0.0725(19) 1 0.054(10) Uani d .
H5C 1 -0.3612 0.3709 -0.0680 1 0.065 Uiso calc R
H5D 1 -0.4215 0.4536 -0.1089 1 0.065 Uiso calc R
C6 1 -0.294(2) 0.465(2) -0.1080(16) 1 0.064(12) Uani d .
H6C 1 -0.3083 0.5257 -0.1280 1 0.077 Uiso calc R
H6D 1 -0.3003 0.4286 -0.1563 1 0.077 Uiso calc R
C7 1 -0.3815(18) 0.592(2) -0.0048(19) 1 0.084(13) Uani d .
H7C 1 -0.3742 0.6236 0.0457 1 0.101 Uiso calc R
H7D 1 -0.4441 0.5867 -0.0391 1 0.101 Uiso calc R
H7E 1 -0.3515 0.6224 -0.0353 1 0.101 Uiso calc R
C8 1 0.0127(18) 0.5941(19) 0.4193(19) 1 0.045(9) Uani d .
H8C 1 -0.0468 0.6145 0.3843 1 0.054 Uiso calc R
H8D 1 0.0190 0.5969 0.4777 1 0.054 Uiso calc R
C9 1 0.0794(17) 0.649(2) 0.4062(19) 1 0.042(8) Uani d .
H9C 1 0.0780 0.7073 0.4293 1 0.051 Uiso calc R
H9D 1 0.0642 0.6556 0.3462 1 0.051 Uiso calc R
C10 1 0.174(2) 0.387(2) 0.270(2) 1 0.045(9) Uani d .
H10C 1 0.1403 0.3747 0.2110 1 0.054 Uiso calc R
H10D 1 0.2369 0.3788 0.2809 1 0.054 Uiso calc R
C11 1 0.1466(17) 0.3207(17) 0.3230(14) 1 0.023(6) Uani d .
H11C 1 0.0819 0.3157 0.3018 1 0.027 Uiso calc R
H11D 1 0.1712 0.2627 0.3201 1 0.027 Uiso calc R
C12 1 0.355(2) 0.442(2) 0.5729(19) 1 0.051(10) Uani d .
H12C 1 0.3526 0.3774 0.5707 1 0.061 Uiso calc R
H12D 1 0.4158 0.4586 0.6090 1 0.061 Uiso calc R
C13 1 0.290(2) 0.477(2) 0.6093(15) 1 0.055(9) Uani d .
H13A 1 0.3002 0.4480 0.6628 1 0.066 Uiso calc R
H13B 1 0.2986 0.5399 0.6193 1 0.066 Uiso calc R
C14 1 0.3783(18) 0.5926(16) 0.504(2) 1 0.053(9) Uani d .
H14A 1 0.3703 0.6258 0.4542 1 0.063 Uiso calc R
H14B 1 0.4410 0.5883 0.5383 1 0.063 Uiso calc R
H14C 1 0.3482 0.6222 0.5355 1 0.063 Uiso calc R
C15 1 0.3167(17) 0.6007(18) 0.2234(16) 1 0.032(7) Uani d .
H15A 1 0.2521 0.6074 0.2015 1 0.038 Uiso calc R
H15B 1 0.3398 0.6141 0.2831 1 0.038 Uiso calc R
C16 1 0.354(2) 0.6594(19) 0.1812(19) 1 0.049(10) Uani d .
H16A 1 0.4188 0.6535 0.2030 1 0.059 Uiso calc R
H16B 1 0.3393 0.7203 0.1885 1 0.059 Uiso calc R
C17 1 0.4824(19) 0.3934(17) 0.0742(15) 1 0.041(8) Uani d .
H17A 1 0.4688 0.3922 0.0141 1 0.049 Uiso calc R
H17B 1 0.5430 0.3721 0.1032 1 0.049 Uiso calc R
C18 1 0.4156(18) 0.334(2) 0.0957(16) 1 0.039(8) Uani d .
H18A 1 0.4158 0.2752 0.0739 1 0.046 Uiso calc R
H18B 1 0.4342 0.3303 0.1564 1 0.046 Uiso calc R
C19 1 0.150(2) 0.556(2) -0.0813(19) 1 0.049(9) Uani d .
H19A 1 0.0895 0.5459 -0.1202 1 0.058 Uiso calc R
H19B 1 0.1594 0.6199 -0.0744 1 0.058 Uiso calc R
C20 1 0.2131(13) 0.519(2) -0.1160(18) 1 0.046(9) Uani d .
H20A 1 0.1981 0.4578 -0.1321 1 0.055 Uiso calc R
H20B 1 0.2100 0.5522 -0.1655 1 0.055 Uiso calc R
C21 1 0.1183(16) 0.4018(19) -0.0050(19) 1 0.052(10) Uani d .
H21A 1 0.1255 0.3667 0.0438 1 0.063 Uiso calc R
H21B 1 0.1460 0.3721 -0.0383 1 0.063 Uiso calc R
H21C 1 0.0557 0.4098 -0.0378 1 0.063 Uiso calc R
C22 1 0.5174(15) 0.398(2) 0.427(2) 1 0.045(9) Uani d .
H22A 1 0.5306 0.3987 0.4870 1 0.054 Uiso calc R
H22B 1 0.4560 0.3791 0.3983 1 0.054 Uiso calc R
C23 1 0.5814(16) 0.3337(18) 0.4074(19) 1 0.052(10) Uani d .
H23A 1 0.5812 0.2765 0.4330 1 0.062 Uiso calc R
H23B 1 0.5623 0.3255 0.3471 1 0.062 Uiso calc R
C24 1 0.6853(19) 0.6039(18) 0.2772(19) 1 0.034(7) Uani d .
H24A 1 0.7498 0.6114 0.2995 1 0.041 Uiso calc R
H24B 1 0.6623 0.6174 0.2175 1 0.041 Uiso calc R
C25 1 0.647(2) 0.660(2) 0.3186(19) 1 0.045(9) Uani d .
H25A 1 0.5824 0.6540 0.2952 1 0.053 Uiso calc R
H25B 1 0.6615 0.7215 0.3118 1 0.053 Uiso calc R
C26 1 0.8506(18) 0.561(2) 0.5791(17) 1 0.042(8) Uani d .
H26A 1 0.9129 0.5571 0.6166 1 0.051 Uiso calc R
H26B 1 0.8354 0.6235 0.5689 1 0.051 Uiso calc R
C27 1 0.792(2) 0.519(2) 0.6216(18) 1 0.051(9) Uani d .
H27A 1 0.8090 0.4576 0.6370 1 0.061 Uiso calc R
H27B 1 0.7958 0.5514 0.6715 1 0.061 Uiso calc R
C28 1 0.8873(18) 0.3959(16) 0.5125(19) 1 0.056(10) Uani d .
H28A 1 0.8841 0.3598 0.4654 1 0.067 Uiso calc R
H28B 1 0.8565 0.3668 0.5434 1 0.067 Uiso calc R
H28C 1 0.9488 0.4046 0.5486 1 0.067 Uiso calc R
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Pd1 0.0250(9) 0.0310(9) 0.0245(7) 0.0021(15) 0.0076(6) 0.0028(14)
Pd2 0.0265(9) 0.0282(9) 0.0280(8) -0.0015(15) 0.0085(7) 0.0002(13)
Co1 0.028(2) 0.021(2) 0.021(2) -0.0005(19) 0.0041(17) 0.0007(18)
Co2 0.024(2) 0.021(2) 0.030(2) 0.001(2) 0.0082(18) 0.0018(19)
Co3 0.029(2) 0.029(3) 0.029(2) -0.009(2) 0.0065(19) -0.005(2)
Co4 0.025(2) 0.032(3) 0.035(3) 0.000(2) 0.0109(19) -0.002(2)
Cl1 0.082(7) 0.065(6) 0.051(6) -0.013(5) 0.015(5) 0.027(5)
Cl2 0.067(7) 0.052(6) 0.069(7) 0.022(5) -0.001(5) -0.005(5)
Cl3 0.096(8) 0.092(8) 0.042(5) -0.005(5) 0.031(6) 0.002(7)
Cl4 0.061(5) 0.042(4) 0.059(6) -0.019(3) 0.015(4) 0.012(4)
Cl5 0.064(7) 0.043(5) 0.069(7) 0.002(5) 0.033(6) 0.005(5)
Cl6 0.052(5) 0.041(5) 0.062(6) -0.012(5) 0.035(5) 0.007(4)
Cl7 0.072(7) 0.038(5) 0.054(6) 0.002(5) 0.025(5) -0.009(5)
Cl8 0.059(6) 0.044(5) 0.070(7) -0.021(5) 0.035(6) -0.011(5)
S1 0.028(4) 0.030(4) 0.031(4) -0.003(4) 0.011(3) 0.000(4)
S2 0.033(4) 0.030(5) 0.034(4) -0.004(4) 0.015(4) -0.001(4)
S3 0.021(3) 0.033(4) 0.048(5) -0.001(4) 0.004(3) 0.008(3)
S4 0.033(4) 0.022(4) 0.032(4) -0.002(3) 0.017(3) -0.003(3)
S5 0.027(4) 0.034(5) 0.034(5) 0.002(4) 0.012(4) -0.005(4)
S6 0.034(4) 0.031(5) 0.041(4) -0.007(4) 0.016(3) 0.000(4)
S7 0.025(4) 0.050(6) 0.032(4) -0.004(4) 0.010(3) -0.001(4)
S8 0.026(4) 0.034(5) 0.038(5) 0.003(4) 0.009(3) -0.002(4)
S9 0.033(5) 0.039(5) 0.065(6) -0.004(5) 0.008(4) 0.005(4)
S10 0.031(4) 0.040(5) 0.019(3) 0.004(3) 0.003(3) 0.007(4)
S11 0.034(4) 0.034(4) 0.027(4) 0.002(4) 0.016(3) 0.007(4)
S12 0.029(4) 0.045(6) 0.049(5) -0.001(5) 0.009(4) -0.009(4)
N1 0.008(8) 0.060(15) 0.040(12) 0.009(10) -0.017(7) -0.017(8)
N2 0.034(12) 0.038(14) 0.005(8) -0.001(9) -0.010(8) 0.008(10)
N3 0.056(17) 0.042(16) 0.063(17) 0.006(13) 0.019(14) 0.015(14)
N4 0.058(16) 0.014(11) 0.047(15) 0.007(10) 0.028(13) 0.002(10)
N5 0.039(13) 0.017(11) 0.063(18) 0.016(11) 0.024(13) 0.018(9)
N6 0.046(15) 0.032(13) 0.019(10) 0.004(10) 0.021(11) -0.006(12)
N7 0.065(17) 0.031(14) 0.035(15) -0.012(12) 0.032(13) -0.010(12)
N8 0.045(13) 0.037(13) 0.046(14) -0.026(10) 0.033(12) -0.020(10)
N9 0.011(8) 0.049(14) 0.028(11) -0.013(10) -0.018(7) 0.020(8)
N10 0.036(14) 0.015(11) 0.035(13) -0.004(9) 0.006(11) 0.008(9)
N11 0.030(13) 0.020(12) 0.056(18) 0.019(12) 0.025(13) 0.013(10)
N12 0.079(18) 0.019(11) 0.027(12) -0.006(9) 0.028(12) -0.016(11)
C1 0.049(18) 0.036(16) 0.022(13) 0.024(11) -0.018(11) -0.004(14)
C2 0.040(18) 0.013(12) 0.08(2) 0.016(13) 0.012(16) 0.013(12)
C3 0.05(2) 0.039(17) 0.049(18) 0.009(14) 0.027(15) -0.019(14)
C4 0.017(12) 0.034(16) 0.058(19) 0.000(14) 0.000(11) -0.008(11)
C5 0.025(13) 0.08(2) 0.049(19) -0.018(16) 0.002(13) -0.006(13)
C6 0.08(2) 0.040(15) 0.021(12) -0.004(10) -0.040(12) 0.015(15)
C7 0.025(16) 0.17(3) 0.051(18) 0.030(19) 0.011(14) 0.030(18)
C8 0.037(15) 0.047(16) 0.056(18) 0.003(13) 0.023(13) -0.027(13)
C9 0.023(14) 0.048(18) 0.051(19) 0.002(15) 0.010(13) -0.006(14)
C10 0.024(13) 0.06(2) 0.041(18) -0.012(16) 0.002(12) -0.003(13)
C11 0.034(13) 0.015(10) 0.015(10) 0.000(8) 0.003(9) -0.009(9)
C12 0.037(18) 0.034(13) 0.050(19) 0.002(12) -0.020(14) 0.007(12)
C13 0.10(2) 0.058(15) 0.011(10) 0.016(10) 0.022(12) 0.042(14)
C14 0.054(17) 0.019(12) 0.11(3) -0.006(14) 0.053(17) -0.015(11)
C15 0.031(15) 0.051(17) 0.019(12) 0.011(11) 0.015(11) -0.010(13)
C16 0.07(2) 0.019(14) 0.05(2) -0.020(14) 0.027(19) -0.001(14)
C17 0.072(19) 0.031(14) 0.027(14) -0.006(11) 0.026(13) 0.031(13)
C18 0.058(19) 0.036(16) 0.032(13) 0.004(12) 0.028(13) 0.004(15)
C19 0.06(2) 0.031(14) 0.053(18) 0.023(12) 0.017(16) 0.006(13)
C20 0.011(9) 0.06(2) 0.065(19) -0.009(16) 0.017(11) -0.013(11)
C21 0.022(13) 0.053(19) 0.06(2) 0.017(15) -0.004(13) 0.025(12)
C22 0.007(10) 0.056(19) 0.07(2) 0.005(16) 0.019(13) -0.003(11)
C23 0.029(14) 0.030(15) 0.07(2) 0.012(13) -0.006(13) -0.034(12)
C24 0.034(16) 0.031(15) 0.038(16) 0.014(12) 0.014(13) 0.002(12)
C25 0.05(2) 0.04(2) 0.05(2) 0.002(16) 0.026(17) -0.004(16)
C26 0.026(14) 0.060(18) 0.036(15) 0.016(13) 0.006(11) -0.003(12)
C27 0.07(2) 0.05(2) 0.025(12) 0.016(13) 0.005(13) 0.009(16)
C28 0.050(16) 0.009(11) 0.08(2) 0.013(12) -0.013(14) 0.021(10)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
Pd1 S4 2.304(8)
Pd1 S2 2.322(8)
Pd1 S5 2.332(8)
Pd1 S1 2.334(9)
Pd2 S7 2.313(9)
Pd2 S8 2.320(8)
Pd2 S10 2.321(8)
Pd2 S11 2.338(8)
Co1 N3 1.90(2)
Co1 N1 1.92(2)
Co1 N2 1.96(2)
Co1 S1 2.245(9)
Co1 S2 2.274(9)
Co1 S3 2.291(8)
Co2 N4 1.98(2)
Co2 N6 1.996(19)
Co2 N5 2.01(2)
Co2 S4 2.260(9)
Co2 S5 2.271(9)
Co2 S6 2.278(9)
Co3 N8 1.98(2)
Co3 N7 1.99(3)
Co3 N9 2.01(2)
Co3 S8 2.247(9)
Co3 S7 2.270(9)
Co3 S9 2.291(9)
Co4 N10 2.00(2)
Co4 N11 2.03(2)
Co4 N12 2.04(2)
Co4 S10 2.251(9)
Co4 S11 2.256(8)
Co4 S12 2.317(9)
S1 C1 1.82(3)
S2 C3 1.81(3)
S3 C5 1.67(3)
S3 C7 1.82(3)
S4 C8 1.82(3)
S5 C10 1.79(3)
S6 C12 1.68(3)
S6 C14 1.82(3)
S8 C15 1.81(3)
S7 C17 1.84(2)
S9 C21 1.72(3)
S9 C19 1.93(3)
S10 C22 1.79(3)
S11 C24 1.89(3)
S12 C28 1.84(2)
S12 C26 1.92(3)
O6 O19 1.8131(3)
O11 O18 1.24237(19)
O12 O16 1.21946(14)
O16 O12 1.21946(13)
N1 C2 1.51(3)
N2 C4 1.39(3)
N3 C6 1.59(3)
N4 C9 1.47(3)
N5 C11 1.48(3)
N6 C13 1.50(3)
N7 C16 1.59(3)
N8 C18 1.50(3)
N9 C20 1.45(3)
N10 C23 1.44(3)
N11 C25 1.53(4)
N12 C27 1.51(3)
C1 C2 1.49(4)
C3 C4 1.62(4)
C5 C6 1.51(4)
C8 C9 1.44(3)
C10 C11 1.52(4)
C12 C13 1.52(4)
C15 C16 1.42(4)
C17 C18 1.55(4)
C19 C20 1.47(4)
C22 C23 1.55(4)
C24 C25 1.40(4)
C26 C27 1.54(4)