#------------------------------------------------------------------------------
#$Date: 2017-07-11 15:10:40 +0300 (Tue, 11 Jul 2017) $
#$Revision: 198633 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/00/59/7005975.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_7005975
loop_
_publ_author_name
'Chong, Siew Huay'
'Henderson, William'
'Hor, T. S. Andy'
_publ_section_title
;
 Stable diplatinum complexes with functional thiolato bridges from
 dialkylation of [Pt2(mu-S)2(P-P)2] [P-P=2 x PPh3, Ph2P(CH2)3PPh2].
;
_journal_issue                   36
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              4008
_journal_page_last               4016
_journal_paper_doi               10.1039/b707526j
_journal_year                    2007
_chemical_formula_sum            'C72 H74 Cl8 F12 P6 Pt2 S2'
_chemical_formula_weight         2091.03
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_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
_audit_creation_method           SHELXL-97
_cell_angle_alpha                112.135(2)
_cell_angle_beta                 101.057(2)
_cell_angle_gamma                94.877(2)
_cell_formula_units_Z            4
_cell_length_a                   13.5578(11)
_cell_length_b                   24.083(2)
_cell_length_c                   27.457(2)
_cell_measurement_reflns_used    8444
_cell_measurement_temperature    223(2)
_cell_measurement_theta_max      22.08
_cell_measurement_theta_min      2.19
_cell_volume                     8027.3(11)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      223(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0897
_diffrn_reflns_av_sigmaI/netI    0.1090
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       31
_diffrn_reflns_limit_k_min       -31
_diffrn_reflns_limit_l_max       35
_diffrn_reflns_limit_l_min       -35
_diffrn_reflns_number            105933
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.47
_exptl_absorpt_coefficient_mu    3.988
_exptl_absorpt_correction_T_max  0.6052
_exptl_absorpt_correction_T_min  0.2984
_exptl_absorpt_correction_type   'Sadabs, (Sheldrick 2001)'
_exptl_crystal_colour            COLOURLESS
_exptl_crystal_density_diffrn    1.730
_exptl_crystal_density_meas      0
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             4112
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.36
_exptl_crystal_size_min          0.14
_refine_diff_density_max         5.712
_refine_diff_density_min         -2.600
_refine_diff_density_rms         0.216
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.046
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1870
_refine_ls_number_reflns         36846
_refine_ls_number_restraints     22
_refine_ls_restrained_S_all      1.049
_refine_ls_R_factor_all          0.1350
_refine_ls_R_factor_gt           0.0814
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1260P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2158
_refine_ls_wR_factor_ref         0.2439
_reflns_number_gt                21540
_reflns_number_total             36846
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b707526j.txt
_cod_data_source_block           6191
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_refine_ls_hydrogen_treatment' value 'contr' was replaced with the
value 'constr' as specified in the replacement file
'src/cod-tools/trunk/data/replacement-values/replacement_values.lst'.

Automatic conversion script
Id: cif_fix_values 5376 2017-05-30 11:51:03Z andrius 
;
_cod_original_cell_volume        8027.4(11)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7005975
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-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
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.73938(3) 0.207724(17) -0.007009(17) 0.03705(12) Uani 1 1 d . . .
Pt2 Pt 0.75902(3) 0.358386(17) 0.052701(16) 0.03643(12) Uani 1 1 d . . .
Pt3 Pt 0.28301(3) 0.803060(17) 0.523526(17) 0.03771(12) Uani 1 1 d . . .
Pt4 Pt 0.25535(3) 0.652289(17) 0.455100(17) 0.03759(12) Uani 1 1 d . . .
P1 P 0.5966(2) 0.13905(13) -0.06215(12) 0.0457(7) Uani 1 1 d . . .
P2 P 0.7867(2) 0.14109(12) 0.03069(12) 0.0431(7) Uani 1 1 d . . .
P3 P 0.6409(2) 0.41652(13) 0.04125(13) 0.0448(7) Uani 1 1 d . . .
P4 P 0.8324(2) 0.42178(13) 0.14028(12) 0.0445(7) Uani 1 1 d . . .
P5 P 0.4246(2) 0.86973(13) 0.58401(12) 0.0425(7) Uani 1 1 d . . .
P6 P 0.2432(3) 0.87530(13) 0.49200(13) 0.0495(8) Uani 1 1 d . . .
P7 P 0.3712(2) 0.59105(13) 0.46120(13) 0.0464(7) Uani 1 1 d . . .
P8 P 0.1774(2) 0.59393(12) 0.36694(12) 0.0443(7) Uani 1 1 d . . .
S1 S 0.6886(2) 0.28426(12) -0.03599(11) 0.0412(6) Uani 1 1 d . . .
S2 S 0.8695(2) 0.28812(11) 0.05737(11) 0.0392(6) Uani 1 1 d . . .
S3 S 0.3311(2) 0.72162(11) 0.54619(11) 0.0399(6) Uani 1 1 d . . .
S4 S 0.1498(2) 0.72625(11) 0.45663(11) 0.0410(6) Uani 1 1 d . . .
C1 C 0.7742(11) 0.2967(6) -0.0766(5) 0.068(4) Uani 1 1 d . . .
H1A H 0.7786 0.3387 -0.0737 0.082 Uiso 1 1 calc R . .
H1B H 0.8427 0.2911 -0.0621 0.082 Uiso 1 1 calc R . .
C2 C 0.7381(10) 0.2540(6) -0.1350(5) 0.054(3) Uani 1 1 d . . .
C3 C 0.6444(11) 0.2497(7) -0.1663(5) 0.069(4) Uani 1 1 d . . .
H3 H 0.5994 0.2743 -0.1503 0.082 Uiso 1 1 calc R . .
C4 C 0.6132(13) 0.2122(8) -0.2190(6) 0.083(5) Uani 1 1 d . . .
H4 H 0.5472 0.2104 -0.2387 0.099 Uiso 1 1 calc R . .
C5 C 0.6755(13) 0.1774(8) -0.2435(6) 0.081(5) Uani 1 1 d . . .
H5 H 0.6540 0.1507 -0.2803 0.098 Uiso 1 1 calc R . .
C6 C 0.7663(16) 0.1812(11) -0.2156(7) 0.147(11) Uani 1 1 d . . .
H6 H 0.8118 0.1586 -0.2332 0.177 Uiso 1 1 calc R . .
C7 C 0.7979(12) 0.2167(10) -0.1620(6) 0.121(8) Uani 1 1 d . . .
H7 H 0.8626 0.2156 -0.1428 0.145 Uiso 1 1 calc R . .
C8 C 0.9750(9) 0.3091(5) 0.0313(5) 0.052(3) Uani 1 1 d . . .
H8A H 0.9467 0.3152 -0.0015 0.063 Uiso 1 1 calc R . .
H8B H 1.0157 0.3478 0.0583 0.063 Uiso 1 1 calc R . .
C9 C 1.0433(8) 0.2630(5) 0.0183(4) 0.044(3) Uani 1 1 d . . .
C10 C 1.1044(9) 0.2517(5) 0.0586(5) 0.056(3) Uani 1 1 d . . .
H10 H 1.1018 0.2730 0.0948 0.067 Uiso 1 1 calc R . .
C11 C 1.1695(10) 0.2100(6) 0.0472(6) 0.063(4) Uani 1 1 d . . .
H11 H 1.2075 0.2018 0.0754 0.076 Uiso 1 1 calc R . .
C12 C 1.1791(11) 0.1809(6) -0.0037(7) 0.073(4) Uani 1 1 d . . .
H12 H 1.2255 0.1538 -0.0114 0.088 Uiso 1 1 calc R . .
C13 C 1.1166(13) 0.1925(7) -0.0455(7) 0.085(5) Uani 1 1 d . . .
H13 H 1.1204 0.1721 -0.0816 0.102 Uiso 1 1 calc R . .
C14 C 1.0528(11) 0.2320(7) -0.0340(6) 0.075(4) Uani 1 1 d . . .
H14 H 1.0128 0.2392 -0.0624 0.089 Uiso 1 1 calc R . .
C15 C 0.5318(9) 0.1025(5) -0.0272(5) 0.058(3) Uani 1 1 d . . .
H15A H 0.5106 0.1340 0.0017 0.069 Uiso 1 1 calc R . .
H15B H 0.4698 0.0755 -0.0529 0.069 Uiso 1 1 calc R . .
C16 C 0.5933(9) 0.0657(5) -0.0026(5) 0.057(3) Uani 1 1 d . . .
H16A H 0.6204 0.0368 -0.0306 0.069 Uiso 1 1 calc R . .
H16B H 0.5476 0.0422 0.0091 0.069 Uiso 1 1 calc R . .
C17 C 0.6817(8) 0.1040(5) 0.0456(4) 0.047(3) Uani 1 1 d . . .
H17A H 0.7084 0.0778 0.0631 0.056 Uiso 1 1 calc R . .
H17B H 0.6549 0.1354 0.0720 0.056 Uiso 1 1 calc R . .
C18 C 0.6771(9) 0.4985(5) 0.0832(5) 0.052(3) Uani 1 1 d . . .
H18A H 0.7313 0.5152 0.0710 0.063 Uiso 1 1 calc R . .
H18B H 0.6181 0.5180 0.0773 0.063 Uiso 1 1 calc R . .
C19 C 0.7140(10) 0.5151(5) 0.1441(5) 0.065(4) Uani 1 1 d . . .
H19A H 0.7156 0.5587 0.1639 0.078 Uiso 1 1 calc R . .
H19B H 0.6657 0.4928 0.1554 0.078 Uiso 1 1 calc R . .
C20 C 0.8197(10) 0.5003(5) 0.1587(5) 0.064(4) Uani 1 1 d . . .
H20A H 0.8460 0.5215 0.1980 0.076 Uiso 1 1 calc R . .
H20B H 0.8642 0.5176 0.1418 0.076 Uiso 1 1 calc R . .
C21 C 0.2542(10) 0.6979(5) 0.5860(5) 0.054(3) Uani 1 1 d . . .
H21A H 0.1817 0.6919 0.5685 0.065 Uiso 1 1 calc R . .
H21B H 0.2694 0.6587 0.5857 0.065 Uiso 1 1 calc R . .
C22 C 0.2733(9) 0.7425(5) 0.6429(5) 0.047(3) Uani 1 1 d . . .
C23 C 0.3611(10) 0.7493(6) 0.6781(5) 0.065(4) Uani 1 1 d . . .
H23 H 0.4111 0.7268 0.6656 0.078 Uiso 1 1 calc R . .
C24 C 0.3813(13) 0.7883(7) 0.7320(6) 0.080(4) Uani 1 1 d . . .
H24 H 0.4450 0.7935 0.7555 0.096 Uiso 1 1 calc R . .
C25 C 0.3076(15) 0.8188(7) 0.7507(6) 0.081(5) Uani 1 1 d . . .
H25 H 0.3191 0.8439 0.7877 0.098 Uiso 1 1 calc R . .
C26 C 0.2201(17) 0.8137(10) 0.7174(7) 0.115(8) Uani 1 1 d . . .
H26 H 0.1707 0.8365 0.7303 0.138 Uiso 1 1 calc R . .
C27 C 0.2008(11) 0.7748(8) 0.6633(6) 0.082(5) Uani 1 1 d . . .
H27 H 0.1372 0.7703 0.6401 0.099 Uiso 1 1 calc R . .
C28 C 0.0490(9) 0.7087(5) 0.4871(6) 0.061(3) Uani 1 1 d . . .
H28A H 0.0150 0.6664 0.4658 0.073 Uiso 1 1 calc R . .
H28B H 0.0799 0.7126 0.5238 0.073 Uiso 1 1 calc R . .
C29 C -0.0292(9) 0.7497(5) 0.4899(5) 0.051(3) Uani 1 1 d . . .
C30 C -0.0760(10) 0.7604(6) 0.4464(6) 0.068(4) Uani 1 1 d . . .
H30 H -0.0579 0.7427 0.4132 0.081 Uiso 1 1 calc R . .
C31 C -0.1487(11) 0.7964(7) 0.4506(7) 0.076(4) Uani 1 1 d . . .
H31 H -0.1790 0.8033 0.4200 0.091 Uiso 1 1 calc R . .
C32 C -0.1784(11) 0.8221(7) 0.4954(7) 0.080(5) Uani 1 1 d . . .
H32 H -0.2297 0.8461 0.4968 0.097 Uiso 1 1 calc R . .
C33 C -0.1304(12) 0.8126(7) 0.5426(7) 0.085(5) Uani 1 1 d . . .
H33 H -0.1506 0.8296 0.5753 0.101 Uiso 1 1 calc R . .
C34 C -0.0562(11) 0.7787(7) 0.5388(6) 0.073(4) Uani 1 1 d . . .
H34 H -0.0215 0.7744 0.5699 0.087 Uiso 1 1 calc R . .
C35 C 0.4939(9) 0.9120(5) 0.5552(5) 0.058(3) Uani 1 1 d . . .
H35A H 0.5563 0.9362 0.5824 0.069 Uiso 1 1 calc R . .
H35B H 0.5143 0.8829 0.5244 0.069 Uiso 1 1 calc R . .
C36 C 0.4362(9) 0.9542(6) 0.5362(5) 0.057(3) Uani 1 1 d . . .
H36A H 0.4841 0.9812 0.5289 0.068 Uiso 1 1 calc R . .
H36B H 0.4070 0.9795 0.5652 0.068 Uiso 1 1 calc R . .
C37 C 0.3502(10) 0.9198(6) 0.4848(5) 0.063(4) Uani 1 1 d . . .
H37A H 0.3796 0.8924 0.4569 0.075 Uiso 1 1 calc R . .
H37B H 0.3241 0.9495 0.4715 0.075 Uiso 1 1 calc R . .
C38 C 0.3349(11) 0.5104(5) 0.4138(5) 0.064(4) Uani 1 1 d . . .
H38A H 0.3949 0.4906 0.4161 0.077 Uiso 1 1 calc R . .
H38B H 0.2832 0.4905 0.4252 0.077 Uiso 1 1 calc R . .
C39 C 0.2929(11) 0.5002(6) 0.3545(6) 0.074(4) Uani 1 1 d . . .
H39A H 0.2927 0.4579 0.3310 0.089 Uiso 1 1 calc R . .
H39B H 0.3378 0.5264 0.3449 0.089 Uiso 1 1 calc R . .
C40 C 0.1839(10) 0.5142(5) 0.3445(5) 0.064(4) Uani 1 1 d . . .
H40A H 0.1441 0.4967 0.3631 0.077 Uiso 1 1 calc R . .
H40B H 0.1520 0.4942 0.3056 0.077 Uiso 1 1 calc R . .
C1A C 0.4954(8) 0.1723(5) -0.0897(5) 0.049(3) Uani 1 1 d . . .
C2A C 0.4715(12) 0.1590(6) -0.1443(6) 0.071(4) Uani 1 1 d . . .
H2A H 0.5046 0.1324 -0.1681 0.086 Uiso 1 1 calc R . .
C3A C 0.3961(14) 0.1869(8) -0.1626(7) 0.091(5) Uani 1 1 d . . .
H3A H 0.3824 0.1820 -0.1990 0.109 Uiso 1 1 calc R . .
C4A C 0.3396(12) 0.2222(8) -0.1287(8) 0.088(5) Uani 1 1 d . . .
H4A H 0.2853 0.2378 -0.1429 0.106 Uiso 1 1 calc R . .
C5A C 0.3638(11) 0.2333(7) -0.0759(6) 0.074(4) Uani 1 1 d . . .
H5A H 0.3286 0.2586 -0.0524 0.088 Uiso 1 1 calc R . .
C6A C 0.4418(9) 0.2073(6) -0.0554(5) 0.062(3) Uani 1 1 d . . .
H6A H 0.4572 0.2138 -0.0186 0.074 Uiso 1 1 calc R . .
C1B C 0.6208(9) 0.0789(5) -0.1189(5) 0.057(3) Uani 1 1 d . . .
C2B C 0.7051(13) 0.0877(8) -0.1373(7) 0.132(9) Uani 1 1 d . . .
H2B H 0.7519 0.1244 -0.1190 0.158 Uiso 1 1 calc R . .
C3B C 0.7215(15) 0.0425(11) -0.1829(9) 0.176(13) Uani 1 1 d . . .
H3B H 0.7782 0.0498 -0.1960 0.212 Uiso 1 1 calc R . .
C4B C 0.6579(13) -0.0118(8) -0.2089(7) 0.107(7) Uani 1 1 d . . .
H4B H 0.6726 -0.0429 -0.2382 0.128 Uiso 1 1 calc R . .
C5B C 0.5745(14) -0.0202(6) -0.1923(5) 0.084(5) Uani 1 1 d . . .
H5B H 0.5294 -0.0575 -0.2109 0.101 Uiso 1 1 calc R . .
C6B C 0.5504(11) 0.0261(5) -0.1463(5) 0.067(4) Uani 1 1 d . . .
H6B H 0.4897 0.0203 -0.1358 0.081 Uiso 1 1 calc R . .
C1C C 0.8446(10) 0.0807(5) -0.0110(5) 0.050(3) Uani 1 1 d . . .
C2C C 0.9025(13) 0.0952(6) -0.0419(7) 0.084(5) Uani 1 1 d . . .
H2C H 0.9080 0.1344 -0.0419 0.100 Uiso 1 1 calc R . .
C3C C 0.9523(15) 0.0533(8) -0.0727(8) 0.106(7) Uani 1 1 d . . .
H3C H 0.9979 0.0649 -0.0904 0.128 Uiso 1 1 calc R . .
C4C C 0.9352(13) -0.0057(7) -0.0777(7) 0.080(5) Uani 1 1 d . . .
H4C H 0.9602 -0.0360 -0.1031 0.096 Uiso 1 1 calc R . .
C5C C 0.8816(11) -0.0204(6) -0.0453(6) 0.070(4) Uani 1 1 d . . .
H5C H 0.8777 -0.0593 -0.0448 0.084 Uiso 1 1 calc R . .
C6C C 0.8322(10) 0.0233(5) -0.0129(5) 0.055(3) Uani 1 1 d . . .
H6C H 0.7909 0.0127 0.0072 0.066 Uiso 1 1 calc R . .
C1D C 0.8757(9) 0.1751(5) 0.0969(5) 0.046(3) Uani 1 1 d . . .
C2D C 0.9740(10) 0.1653(6) 0.1043(6) 0.063(4) Uani 1 1 d . . .
H2D H 0.9963 0.1404 0.0743 0.076 Uiso 1 1 calc R . .
C3D C 1.0437(11) 0.1914(7) 0.1561(7) 0.079(4) Uani 1 1 d . . .
H3D H 1.1105 0.1832 0.1617 0.095 Uiso 1 1 calc R . .
C4D C 1.0070(13) 0.2298(7) 0.1977(6) 0.080(5) Uani 1 1 d . . .
H4D H 1.0518 0.2499 0.2321 0.096 Uiso 1 1 calc R . .
C5D C 0.9120(13) 0.2396(6) 0.1913(6) 0.070(4) Uani 1 1 d . . .
H5D H 0.8900 0.2647 0.2213 0.084 Uiso 1 1 calc R . .
C6D C 0.8444(11) 0.2131(6) 0.1407(5) 0.059(3) Uani 1 1 d . . .
H6D H 0.7774 0.2211 0.1363 0.071 Uiso 1 1 calc R . .
C1E C 0.6087(9) 0.4129(5) -0.0267(5) 0.048(3) Uani 1 1 d . . .
C2E C 0.5139(9) 0.3827(6) -0.0632(5) 0.053(3) Uani 1 1 d . . .
H2E H 0.4632 0.3653 -0.0517 0.064 Uiso 1 1 calc R . .
C3E C 0.4953(11) 0.3785(6) -0.1148(5) 0.065(4) Uani 1 1 d . . .
H3E H 0.4328 0.3569 -0.1392 0.078 Uiso 1 1 calc R . .
C4E C 0.5675(13) 0.4058(7) -0.1320(6) 0.077(4) Uani 1 1 d . . .
H4E H 0.5532 0.4034 -0.1677 0.092 Uiso 1 1 calc R . .
C5E C 0.6576(13) 0.4357(7) -0.0979(6) 0.076(4) Uani 1 1 d . . .
H5E H 0.7058 0.4549 -0.1096 0.091 Uiso 1 1 calc R . .
C6E C 0.6803(10) 0.4383(6) -0.0461(6) 0.064(4) Uani 1 1 d . . .
H6E H 0.7453 0.4576 -0.0232 0.077 Uiso 1 1 calc R . .
C1F C 0.5199(9) 0.3946(5) 0.0536(5) 0.052(3) Uani 1 1 d . . .
C2F C 0.5058(10) 0.3427(6) 0.0649(5) 0.059(3) Uani 1 1 d . . .
H2F H 0.5591 0.3205 0.0671 0.071 Uiso 1 1 calc R . .
C3F C 0.4134(12) 0.3244(7) 0.0728(6) 0.076(4) Uani 1 1 d . . .
H3F H 0.4042 0.2904 0.0815 0.091 Uiso 1 1 calc R . .
C4F C 0.3307(12) 0.3572(7) 0.0678(7) 0.084(5) Uani 1 1 d . . .
H4F H 0.2681 0.3452 0.0740 0.101 Uiso 1 1 calc R . .
C5F C 0.3436(11) 0.4061(8) 0.0539(7) 0.084(5) Uani 1 1 d . . .
H5F H 0.2892 0.4264 0.0481 0.101 Uiso 1 1 calc R . .
C6F C 0.4401(12) 0.4246(7) 0.0487(7) 0.081(5) Uani 1 1 d . . .
H6F H 0.4505 0.4596 0.0415 0.097 Uiso 1 1 calc R . .
C1I C 0.7845(9) 0.3994(5) 0.1877(5) 0.055(3) Uani 1 1 d . . .
C2I C 0.8229(13) 0.4322(7) 0.2440(5) 0.086(5) Uani 1 1 d . . .
H2I H 0.8689 0.4690 0.2570 0.103 Uiso 1 1 calc R . .
C3I C 0.7939(18) 0.4112(9) 0.2803(8) 0.123(8) Uani 1 1 d . . .
H3I H 0.8234 0.4318 0.3177 0.148 Uiso 1 1 calc R . .
C4I C 0.7202(14) 0.3590(7) 0.2607(8) 0.092(5) Uani 1 1 d . . .
H4I H 0.6940 0.3468 0.2852 0.111 Uiso 1 1 calc R . .
C5I C 0.6861(11) 0.3258(7) 0.2072(6) 0.072(4) Uani 1 1 d . . .
H5I H 0.6393 0.2894 0.1947 0.086 Uiso 1 1 calc R . .
C6I C 0.7187(9) 0.3442(6) 0.1707(6) 0.059(3) Uani 1 1 d . . .
H6I H 0.6963 0.3194 0.1335 0.071 Uiso 1 1 calc R . .
C1J C 0.9684(8) 0.4236(5) 0.1575(4) 0.043(3) Uani 1 1 d . . .
C2J C 1.0109(10) 0.3915(6) 0.1861(4) 0.055(3) Uani 1 1 d . . .
H2J H 0.9684 0.3705 0.1992 0.066 Uiso 1 1 calc R . .
C3J C 1.1133(11) 0.3892(6) 0.1959(6) 0.067(4) Uani 1 1 d . . .
H3J H 1.1410 0.3680 0.2164 0.081 Uiso 1 1 calc R . .
C4J C 1.1723(12) 0.4175(7) 0.1761(6) 0.081(5) Uani 1 1 d . . .
H4J H 1.2422 0.4153 0.1827 0.098 Uiso 1 1 calc R . .
C5J C 1.1376(10) 0.4495(6) 0.1465(6) 0.067(4) Uani 1 1 d . . .
H5J H 1.1818 0.4684 0.1326 0.081 Uiso 1 1 calc R . .
C6J C 1.0324(10) 0.4533(5) 0.1375(5) 0.055(3) Uani 1 1 d . . .
H6J H 1.0058 0.4757 0.1181 0.066 Uiso 1 1 calc R . .
C1K C 0.3928(10) 0.9271(5) 0.6419(5) 0.051(3) Uani 1 1 d . . .
C2K C 0.4535(12) 0.9841(5) 0.6681(5) 0.078(5) Uani 1 1 d . . .
H2K H 0.5116 0.9939 0.6571 0.093 Uiso 1 1 calc R . .
C3K C 0.4248(15) 1.0263(6) 0.7118(6) 0.093(6) Uani 1 1 d . . .
H3K H 0.4622 1.0661 0.7292 0.112 Uiso 1 1 calc R . .
C4K C 0.3463(13) 1.0115(7) 0.7291(6) 0.078(5) Uani 1 1 d . . .
H4K H 0.3304 1.0403 0.7595 0.094 Uiso 1 1 calc R . .
C5K C 0.2894(13) 0.9562(9) 0.7038(7) 0.108(7) Uani 1 1 d . . .
H5K H 0.2329 0.9465 0.7160 0.130 Uiso 1 1 calc R . .
C6K C 0.3131(11) 0.9131(7) 0.6595(6) 0.083(5) Uani 1 1 d . . .
H6K H 0.2732 0.8739 0.6420 0.099 Uiso 1 1 calc R . .
C1L C 0.5216(8) 0.8342(5) 0.6105(5) 0.047(3) Uani 1 1 d . . .
C2L C 0.5428(11) 0.8418(6) 0.6636(5) 0.059(3) Uani 1 1 d . . .
H2L H 0.5078 0.8668 0.6873 0.071 Uiso 1 1 calc R . .
C3L C 0.6154(13) 0.8132(7) 0.6827(6) 0.082(5) Uani 1 1 d . . .
H3L H 0.6276 0.8180 0.7190 0.099 Uiso 1 1 calc R . .
C4L C 0.6691(12) 0.7785(7) 0.6500(8) 0.091(5) Uani 1 1 d . . .
H4L H 0.7188 0.7596 0.6635 0.109 Uiso 1 1 calc R . .
C5L C 0.6498(11) 0.7710(7) 0.5960(7) 0.075(4) Uani 1 1 d . . .
H5L H 0.6864 0.7468 0.5728 0.090 Uiso 1 1 calc R . .
C6L C 0.5769(10) 0.7993(6) 0.5765(6) 0.064(4) Uani 1 1 d . . .
H6L H 0.5648 0.7948 0.5402 0.077 Uiso 1 1 calc R . .
C1M C 0.1779(10) 0.9284(5) 0.5326(5) 0.056(3) Uani 1 1 d . . .
C2M C 0.1892(13) 0.9885(7) 0.5371(8) 0.108(7) Uani 1 1 d . . .
H2M H 0.2340 1.0022 0.5202 0.129 Uiso 1 1 calc R . .
C3M C 0.1318(14) 1.0281(6) 0.5676(10) 0.127(9) Uani 1 1 d . . .
H3M H 0.1384 1.0686 0.5708 0.153 Uiso 1 1 calc R . .
C4M C 0.0674(12) 1.0091(6) 0.5926(7) 0.092(6) Uani 1 1 d . . .
H4M H 0.0322 1.0366 0.6142 0.110 Uiso 1 1 calc R . .
C5M C 0.0534(15) 0.9480(8) 0.5861(8) 0.105(6) Uani 1 1 d . . .
H5M H 0.0060 0.9334 0.6012 0.126 Uiso 1 1 calc R . .
C6M C 0.1111(12) 0.9103(6) 0.5571(6) 0.077(5) Uani 1 1 d . . .
H6M H 0.1041 0.8699 0.5540 0.093 Uiso 1 1 calc R . .
C1N C 0.1605(10) 0.8450(5) 0.4237(5) 0.057(3) Uani 1 1 d . . .
C2N C 0.0652(11) 0.8555(7) 0.4123(6) 0.070(4) Uani 1 1 d . . .
H2N H 0.0372 0.8786 0.4407 0.085 Uiso 1 1 calc R . .
C3N C 0.0066(14) 0.8326(7) 0.3592(7) 0.087(5) Uani 1 1 d . . .
H3N H -0.0583 0.8429 0.3517 0.104 Uiso 1 1 calc R . .
C4N C 0.0437(14) 0.7950(8) 0.3177(7) 0.086(5) Uani 1 1 d . . .
H4N H 0.0032 0.7765 0.2820 0.103 Uiso 1 1 calc R . .
C5N C 0.1403(15) 0.7857(7) 0.3301(6) 0.087(5) Uani 1 1 d . . .
H5N H 0.1676 0.7617 0.3018 0.105 Uiso 1 1 calc R . .
C6N C 0.1990(11) 0.8085(6) 0.3803(5) 0.063(3) Uani 1 1 d . . .
H6N H 0.2657 0.8003 0.3868 0.075 Uiso 1 1 calc R . .
C1O C 0.4929(9) 0.6174(5) 0.4527(5) 0.053(3) Uani 1 1 d . . .
C2O C 0.5091(10) 0.6704(6) 0.4447(5) 0.059(3) Uani 1 1 d . . .
H2O H 0.4558 0.6928 0.4434 0.071 Uiso 1 1 calc R . .
C3O C 0.6011(11) 0.6910(7) 0.4387(6) 0.074(4) Uani 1 1 d . . .
H3O H 0.6094 0.7257 0.4309 0.089 Uiso 1 1 calc R . .
C4O C 0.6838(11) 0.6602(7) 0.4441(6) 0.076(4) Uani 1 1 d . . .
H4O H 0.7485 0.6750 0.4418 0.092 Uiso 1 1 calc R . .
C5O C 0.6671(11) 0.6081(7) 0.4528(7) 0.081(5) Uani 1 1 d . . .
H5O H 0.7209 0.5866 0.4559 0.098 Uiso 1 1 calc R . .
C6O C 0.5734(10) 0.5868(7) 0.4570(6) 0.071(4) Uani 1 1 d . . .
H6O H 0.5639 0.5509 0.4628 0.085 Uiso 1 1 calc R . .
C1P C 0.3974(8) 0.5866(5) 0.5261(5) 0.047(3) Uani 1 1 d . . .
C2P C 0.4887(10) 0.6166(6) 0.5646(5) 0.060(3) Uani 1 1 d . . .
H2P H 0.5403 0.6366 0.5555 0.072 Uiso 1 1 calc R . .
C3P C 0.5040(12) 0.6173(7) 0.6156(6) 0.071(4) Uani 1 1 d . . .
H3P H 0.5640 0.6398 0.6420 0.086 Uiso 1 1 calc R . .
C4P C 0.4301(15) 0.5846(8) 0.6280(7) 0.084(5) Uani 1 1 d . . .
H4P H 0.4416 0.5838 0.6626 0.100 Uiso 1 1 calc R . .
C5P C 0.3447(14) 0.5548(7) 0.5919(7) 0.082(5) Uani 1 1 d . . .
H5P H 0.2956 0.5329 0.6009 0.099 Uiso 1 1 calc R . .
C6P C 0.3252(11) 0.5552(6) 0.5393(6) 0.066(4) Uani 1 1 d . . .
H6P H 0.2635 0.5341 0.5138 0.079 Uiso 1 1 calc R . .
C1Q C 0.0412(9) 0.5942(5) 0.3523(4) 0.048(3) Uani 1 1 d . . .
C2Q C -0.0176(10) 0.5655(6) 0.3741(5) 0.062(3) Uani 1 1 d . . .
H2Q H 0.0109 0.5447 0.3947 0.075 Uiso 1 1 calc R . .
C3Q C -0.1255(11) 0.5686(7) 0.3644(6) 0.076(4) Uani 1 1 d . . .
H3Q H -0.1689 0.5486 0.3778 0.091 Uiso 1 1 calc R . .
C4Q C -0.1638(12) 0.6006(8) 0.3358(7) 0.089(5) Uani 1 1 d . . .
H4Q H -0.2326 0.6053 0.3321 0.107 Uiso 1 1 calc R . .
C5Q C -0.1066(12) 0.6245(8) 0.3135(6) 0.080(5) Uani 1 1 d . . .
H5Q H -0.1367 0.6425 0.2907 0.096 Uiso 1 1 calc R . .
C6Q C -0.0026(10) 0.6245(6) 0.3222(5) 0.058(3) Uani 1 1 d . . .
H6Q H 0.0378 0.6448 0.3077 0.070 Uiso 1 1 calc R . .
C1R C 0.2255(10) 0.6174(5) 0.3203(5) 0.056(3) Uani 1 1 d . . .
C2R C 0.3008(10) 0.6701(5) 0.3388(6) 0.064(4) Uani 1 1 d . . .
H2R H 0.3274 0.6929 0.3762 0.077 Uiso 1 1 calc R . .
C3R C 0.3351(13) 0.6877(7) 0.3019(7) 0.084(5) Uani 1 1 d . . .
H3R H 0.3877 0.7214 0.3144 0.101 Uiso 1 1 calc R . .
C4R C 0.2947(16) 0.6575(7) 0.2478(7) 0.104(6) Uani 1 1 d . . .
H4R H 0.3204 0.6698 0.2233 0.125 Uiso 1 1 calc R . .
C5R C 0.2142(19) 0.6078(8) 0.2284(7) 0.128(9) Uani 1 1 d . . .
H5R H 0.1822 0.5887 0.1912 0.154 Uiso 1 1 calc R . .
C6R C 0.1836(13) 0.5878(7) 0.2637(6) 0.090(5) Uani 1 1 d . . .
H6R H 0.1327 0.5530 0.2503 0.108 Uiso 1 1 calc R . .
P9 P 0.3546(3) 0.29528(19) 0.21871(15) 0.0660(10) Uani 1 1 d . . .
F1 F 0.3711(12) 0.3628(5) 0.2461(6) 0.190(8) Uani 1 1 d . . .
F2 F 0.4450(10) 0.2941(6) 0.2613(4) 0.173(6) Uani 1 1 d . . .
F3 F 0.3346(12) 0.2233(5) 0.1903(6) 0.185(6) Uani 1 1 d . . .
F4 F 0.2643(10) 0.2934(6) 0.1750(4) 0.176(6) Uani 1 1 d . . .
F5 F 0.2826(10) 0.2901(7) 0.2554(6) 0.172(6) Uani 1 1 d . . .
F6 F 0.4248(12) 0.2934(11) 0.1823(8) 0.244(10) Uani 1 1 d . . .
P10 P 0.4415(3) 0.14278(16) 0.60557(15) 0.0604(9) Uani 1 1 d . . .
F7 F 0.4829(7) 0.1917(4) 0.6652(3) 0.109(3) Uani 1 1 d . . .
F8 F 0.3777(9) 0.1015(5) 0.6256(5) 0.133(4) Uani 1 1 d . . .
F9 F 0.4034(8) 0.0930(5) 0.5456(4) 0.116(4) Uani 1 1 d . . .
F10 F 0.5074(9) 0.1827(4) 0.5847(4) 0.116(4) Uani 1 1 d . . .
F11 F 0.3513(9) 0.1765(6) 0.5980(4) 0.156(5) Uani 1 1 d . . .
F12 F 0.5335(9) 0.1085(6) 0.6124(5) 0.134(4) Uani 1 1 d . . .
P11 P 0.2321(3) 0.00371(16) 0.86887(14) 0.0556(8) Uani 1 1 d . . .
F13 F 0.2711(8) 0.0350(5) 0.9318(4) 0.117(4) Uani 1 1 d . . .
F14 F 0.1618(7) -0.0470(5) 0.8746(4) 0.106(3) Uani 1 1 d . . .
F15 F 0.1946(9) -0.0249(6) 0.8068(4) 0.133(4) Uani 1 1 d . . .
F16 F 0.3011(7) 0.0557(4) 0.8631(4) 0.095(3) Uani 1 1 d . . .
F17 F 0.1399(8) 0.0373(5) 0.8718(5) 0.138(4) Uani 1 1 d . . .
F18 F 0.3230(8) -0.0298(5) 0.8683(6) 0.139(5) Uani 1 1 d . . .
P12 P 0.0000 0.5000 0.5000 0.094(2) Uani 1 2 d S . .
F19 F 0.0757(9) 0.4963(6) 0.4623(5) 0.127(4) Uani 1 1 d . . .
F20 F 0.0366(17) 0.5669(6) 0.5223(9) 0.242(11) Uani 1 1 d . . .
F21 F 0.0848(10) 0.4979(13) 0.5416(8) 0.258(12) Uani 1 1 d . . .
P13 P 1.0000 0.5000 1.0000 0.092(2) Uani 1 2 d S . .
F22 F 0.9133(9) 0.4999(12) 0.9567(8) 0.264(13) Uani 1 1 d . . .
F23 F 0.9683(16) 0.4331(6) 0.9815(9) 0.231(10) Uani 1 1 d . . .
F24 F 0.9253(8) 0.5063(6) 1.0381(5) 0.130(4) Uani 1 1 d . . .
C1S C 0.0227(12) 0.1018(11) 0.2449(6) 0.148(9) Uani 1 1 d D . .
H1S1 H -0.0234 0.0625 0.2295 0.178 Uiso 1 1 calc R . .
H1S2 H -0.0068 0.1272 0.2272 0.178 Uiso 1 1 calc R . .
Cl1A Cl 0.0273(8) 0.1349(8) 0.3107(3) 0.336(9) Uani 1 1 d D . .
Cl1B Cl 0.1320(7) 0.0902(6) 0.2300(4) 0.274(7) Uani 1 1 d D . .
C2S C 0.6740(17) 0.7289(8) 0.2854(9) 0.151(10) Uani 1 1 d D . .
H2S1 H 0.7138 0.7490 0.3231 0.182 Uiso 1 1 calc R . .
H2S2 H 0.6232 0.7539 0.2798 0.182 Uiso 1 1 calc R . .
Cl2A Cl 0.7538(5) 0.7250(4) 0.2433(3) 0.172(3) Uani 1 1 d D . .
Cl2B Cl 0.6140(5) 0.6606(4) 0.2751(3) 0.152(3) Uani 1 1 d D . .
C3S C 0.937(3) 0.9194(12) 0.2255(15) 0.45(4) Uani 1 1 d D . .
H3S1 H 0.9941 0.9530 0.2462 0.539 Uiso 1 1 calc R . .
H3S2 H 0.8908 0.9302 0.1995 0.539 Uiso 1 1 calc R . .
Cl3A Cl 0.9776(9) 0.8529(8) 0.1939(4) 0.352(10) Uani 1 1 d D . .
Cl3B Cl 0.8747(10) 0.9015(8) 0.2666(4) 0.354(10) Uani 1 1 d D . .
C4S C 0.4809(17) 0.1233(10) 0.1190(9) 0.180(14) Uani 1 1 d D . .
H4S1 H 0.5283 0.0954 0.1069 0.216 Uiso 1 1 calc R . .
H4S2 H 0.4824 0.1328 0.1571 0.216 Uiso 1 1 calc R . .
Cl4A Cl 0.3609(14) 0.0980(8) 0.0780(11) 0.60(2) Uani 1 1 d D . .
Cl4B Cl 0.5009(14) 0.1904(7) 0.1052(8) 0.439(11) Uani 1 1 d D . .
C5S C 0.9401(16) 0.6657(18) 0.1179(12) 0.25(2) Uani 1 1 d D . .
H5S1 H 0.9716 0.6393 0.0905 0.303 Uiso 1 1 calc R . .
H5S2 H 0.9636 0.7081 0.1247 0.303 Uiso 1 1 calc R . .
Cl5A Cl 0.8043(9) 0.6472(4) 0.0956(5) 0.255(5) Uani 1 1 d D . .
Cl5B Cl 0.9729(12) 0.6541(5) 0.1787(5) 0.324(8) Uani 1 1 d D . .
C6S C 0.245(2) 0.9568(7) 0.3615(7) 0.192(15) Uani 1 1 d D . .
H6S1 H 0.3107 0.9455 0.3724 0.231 Uiso 1 1 calc R . .
H6S2 H 0.1904 0.9211 0.3452 0.231 Uiso 1 1 calc R . .
Cl6A Cl 0.2165(7) 1.0189(5) 0.4140(4) 0.227(4) Uani 1 1 d D . .
Cl6B Cl 0.2481(10) 0.9978(9) 0.3227(5) 0.418(12) Uani 1 1 d D . .
C7SA C 0.463(3) 0.5288(13) 0.7535(7) 0.143 Uiso 0.60 1 d PD A 1
H7S1 H 0.4983 0.5667 0.7545 0.172 Uiso 0.60 1 calc PR A 1
H7S2 H 0.3955 0.5350 0.7595 0.172 Uiso 0.60 1 calc PR A 1
Cl7B Cl 0.4507(7) 0.4700(4) 0.6894(3) 0.115(3) Uani 0.60 1 d PD A 1
Cl7A Cl 0.5326(6) 0.5113(4) 0.8050(3) 0.104(2) Uani 0.60 1 d PD A 1
C7SB C 0.5266(17) 0.5297(15) 0.756(2) 0.140 Uiso 0.40 1 d PD B 2
H7S3 H 0.5492 0.5428 0.7295 0.168 Uiso 0.40 1 calc PR B 2
H7S4 H 0.5482 0.5643 0.7912 0.168 Uiso 0.40 1 calc PR B 2
Cl7C Cl 0.5894(9) 0.4722(6) 0.7598(6) 0.105(4) Uani 0.40 1 d PD B 2
Cl7D Cl 0.3936(9) 0.5137(8) 0.7381(7) 0.136(6) Uani 0.40 1 d PD B 2
C8SA C 0.045(3) 0.342(4) 0.374(3) 0.200 Uiso 0.50 1 d PD C 1
H8S1 H 0.0063 0.3707 0.3948 0.240 Uiso 0.50 1 calc PR C 1
H8S2 H 0.0049 0.3013 0.3571 0.240 Uiso 0.50 1 calc PR C 1
Cl8A Cl 0.162(3) 0.3445(17) 0.4141(14) 0.37(2) Uani 0.50 1 d PD C 1
Cl8B Cl 0.077(3) 0.3645(7) 0.3242(7) 0.283(18) Uani 0.50 1 d PD C 1
C8SB C 0.082(2) 0.355(4) 0.3945(19) 0.200 Uiso 0.50 1 d PD D 2
H8S3 H 0.0682 0.3197 0.4028 0.240 Uiso 0.50 1 calc PR D 2
H8S4 H 0.0854 0.3921 0.4268 0.240 Uiso 0.50 1 calc PR D 2
Cl8C Cl -0.0121(19) 0.352(2) 0.3407(12) 0.63(5) Uani 0.50 1 d PD D 2
Cl8D Cl 0.1950(15) 0.3564(7) 0.3740(16) 0.254(17) Uani 0.50 1 d PD D 2
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'
F F 0.0171 0.0103 '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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 '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'
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
P1 Pt1 P2 90.32(11) . . ?
P1 Pt1 S1 92.58(10) . . ?
P2 Pt1 S1 173.36(10) . . ?
P1 Pt1 S2 170.90(10) . . ?
P2 Pt1 S2 92.79(10) . . ?
S1 Pt1 S2 83.48(9) . . ?
P3 Pt2 P4 94.57(11) . . ?
P3 Pt2 S1 90.70(10) . . ?
P4 Pt2 S1 174.06(10) . . ?
P3 Pt2 S2 173.68(10) . . ?
P4 Pt2 S2 90.99(10) . . ?
S1 Pt2 S2 83.61(9) . . ?
P6 Pt3 P5 89.62(11) . . ?
P6 Pt3 S3 172.81(10) . . ?
P5 Pt3 S3 92.31(10) . . ?
P6 Pt3 S4 93.81(11) . . ?
P5 Pt3 S4 173.21(10) . . ?
S3 Pt3 S4 83.58(9) . . ?
P7 Pt4 P8 94.79(11) . . ?
P7 Pt4 S4 173.01(10) . . ?
P8 Pt4 S4 91.20(10) . . ?
P7 Pt4 S3 90.29(10) . . ?
P8 Pt4 S3 174.44(10) . . ?
S4 Pt4 S3 83.59(9) . . ?
C1B P1 C15 106.2(6) . . ?
C1B P1 C1A 106.5(6) . . ?
C15 P1 C1A 101.9(6) . . ?
C1B P1 Pt1 113.7(4) . . ?
C15 P1 Pt1 113.2(4) . . ?
C1A P1 Pt1 114.4(3) . . ?
C17 P2 C1D 101.0(5) . . ?
C17 P2 C1C 106.6(5) . . ?
C1D P2 C1C 105.6(6) . . ?
C17 P2 Pt1 113.1(4) . . ?
C1D P2 Pt1 115.3(3) . . ?
C1C P2 Pt1 114.0(4) . . ?
C1E P3 C1F 104.6(6) . . ?
C1E P3 C18 103.3(5) . . ?
C1F P3 C18 104.8(5) . . ?
C1E P3 Pt2 112.7(4) . . ?
C1F P3 Pt2 114.0(4) . . ?
C18 P3 Pt2 116.1(4) . . ?
C1I P4 C20 105.8(6) . . ?
C1I P4 C1J 105.1(6) . . ?
C20 P4 C1J 104.3(6) . . ?
C1I P4 Pt2 113.0(4) . . ?
C20 P4 Pt2 115.7(4) . . ?
C1J P4 Pt2 112.1(4) . . ?
C35 P5 C1L 102.7(6) . . ?
C35 P5 C1K 105.4(5) . . ?
C1L P5 C1K 107.3(6) . . ?
C35 P5 Pt3 113.6(4) . . ?
C1L P5 Pt3 114.5(4) . . ?
C1K P5 Pt3 112.3(4) . . ?
C1M P6 C37 106.4(6) . . ?
C1M P6 C1N 104.9(6) . . ?
C37 P6 C1N 101.6(6) . . ?
C1M P6 Pt3 113.1(4) . . ?
C37 P6 Pt3 115.6(4) . . ?
C1N P6 Pt3 114.2(4) . . ?
C1P P7 C1O 105.9(6) . . ?
C1P P7 C38 102.6(6) . . ?
C1O P7 C38 105.9(6) . . ?
C1P P7 Pt4 111.9(4) . . ?
C1O P7 Pt4 112.7(4) . . ?
C38 P7 Pt4 116.7(5) . . ?
C1R P8 C40 105.0(6) . . ?
C1R P8 C1Q 106.4(6) . . ?
C40 P8 C1Q 102.9(6) . . ?
C1R P8 Pt4 113.6(4) . . ?
C40 P8 Pt4 115.8(4) . . ?
C1Q P8 Pt4 112.1(4) . . ?
C1 S1 Pt2 105.2(4) . . ?
C1 S1 Pt1 108.4(5) . . ?
Pt2 S1 Pt1 89.60(10) . . ?
C8 S2 Pt1 115.5(4) . . ?
C8 S2 Pt2 103.7(4) . . ?
Pt1 S2 Pt2 89.15(9) . . ?
C21 S3 Pt3 115.8(4) . . ?
C21 S3 Pt4 103.7(4) . . ?
Pt3 S3 Pt4 89.48(9) . . ?
C28 S4 Pt4 104.4(4) . . ?
C28 S4 Pt3 110.6(5) . . ?
Pt4 S4 Pt3 89.67(9) . . ?
C2 C1 S1 112.0(9) . . ?
C3 C2 C7 113.9(12) . . ?
C3 C2 C1 123.5(13) . . ?
C7 C2 C1 122.6(13) . . ?
C4 C3 C2 123.3(14) . . ?
C5 C4 C3 120.2(15) . . ?
C6 C5 C4 118.6(15) . . ?
C5 C6 C7 122.2(17) . . ?
C6 C7 C2 121.7(15) . . ?
C9 C8 S2 114.0(8) . . ?
C10 C9 C14 116.9(12) . . ?
C10 C9 C8 121.1(11) . . ?
C14 C9 C8 121.9(11) . . ?
C9 C10 C11 121.7(13) . . ?
C12 C11 C10 120.8(13) . . ?
C11 C12 C13 117.8(13) . . ?
C14 C13 C12 120.6(15) . . ?
C13 C14 C9 122.1(14) . . ?
C16 C15 P1 115.8(8) . . ?
C15 C16 C17 114.1(10) . . ?
C16 C17 P2 116.1(8) . . ?
C19 C18 P3 114.8(8) . . ?
C20 C19 C18 112.1(10) . . ?
C19 C20 P4 118.3(8) . . ?
C22 C21 S3 113.4(8) . . ?
C23 C22 C27 116.8(12) . . ?
C23 C22 C21 120.0(11) . . ?
C27 C22 C21 123.0(12) . . ?
C22 C23 C24 122.5(13) . . ?
C25 C24 C23 118.9(15) . . ?
C26 C25 C24 120.6(15) . . ?
C25 C26 C27 120.0(15) . . ?
C22 C27 C26 121.1(14) . . ?
C29 C28 S4 112.8(9) . . ?
C30 C29 C34 117.6(12) . . ?
C30 C29 C28 122.9(12) . . ?
C34 C29 C28 119.5(12) . . ?
C31 C30 C29 120.6(15) . . ?
C32 C31 C30 123.0(16) . . ?
C31 C32 C33 118.4(14) . . ?
C34 C33 C32 118.5(14) . . ?
C33 C34 C29 121.9(14) . . ?
C36 C35 P5 115.5(9) . . ?
C35 C36 C37 112.8(10) . . ?
C36 C37 P6 116.3(8) . . ?
C39 C38 P7 114.3(9) . . ?
C38 C39 C40 111.9(11) . . ?
C39 C40 P8 114.4(9) . . ?
C6A C1A C2A 121.9(12) . . ?
C6A C1A P1 118.7(10) . . ?
C2A C1A P1 119.2(10) . . ?
C1A C2A C3A 116.6(13) . . ?
C2A C3A C4A 122.3(15) . . ?
C5A C4A C3A 119.3(15) . . ?
C4A C5A C6A 120.0(14) . . ?
C1A C6A C5A 119.5(12) . . ?
C2B C1B C6B 120.4(12) . . ?
C2B C1B P1 119.7(10) . . ?
C6B C1B P1 119.7(10) . . ?
C1B C2B C3B 120.0(15) . . ?
C4B C3B C2B 121.6(19) . . ?
C5B C4B C3B 118.8(15) . . ?
C4B C5B C6B 122.3(14) . . ?
C1B C6B C5B 116.7(14) . . ?
C6C C1C C2C 119.8(11) . . ?
C6C C1C P2 123.1(10) . . ?
C2C C1C P2 117.1(9) . . ?
C3C C2C C1C 120.9(13) . . ?
C4C C3C C2C 119.7(15) . . ?
C3C C4C C5C 119.7(13) . . ?
C4C C5C C6C 119.6(12) . . ?
C1C C6C C5C 119.5(12) . . ?
C2D C1D C6D 118.7(12) . . ?
C2D C1D P2 121.7(10) . . ?
C6D C1D P2 119.5(10) . . ?
C1D C2D C3D 121.9(13) . . ?
C4D C3D C2D 115.7(14) . . ?
C5D C4D C3D 123.1(15) . . ?
C4D C5D C6D 120.5(14) . . ?
C1D C6D C5D 119.9(13) . . ?
C6E C1E C2E 117.0(12) . . ?
C6E C1E P3 120.2(10) . . ?
C2E C1E P3 122.7(9) . . ?
C3E C2E C1E 120.5(12) . . ?
C2E C3E C4E 120.6(14) . . ?
C5E C4E C3E 120.1(14) . . ?
C4E C5E C6E 120.5(15) . . ?
C5E C6E C1E 121.1(14) . . ?
C6F C1F C2F 119.0(12) . . ?
C6F C1F P3 122.0(10) . . ?
C2F C1F P3 118.8(9) . . ?
C3F C2F C1F 119.5(13) . . ?
C2F C3F C4F 120.2(14) . . ?
C5F C4F C3F 119.8(13) . . ?
C4F C5F C6F 118.0(15) . . ?
C1F C6F C5F 123.3(15) . . ?
C6I C1I C2I 117.0(13) . . ?
C6I C1I P4 121.2(10) . . ?
C2I C1I P4 121.2(10) . . ?
C3I C2I C1I 121.0(15) . . ?
C2I C3I C4I 118.9(18) . . ?
C5I C4I C3I 120.6(17) . . ?
C4I C5I C6I 120.9(15) . . ?
C5I C6I C1I 121.2(13) . . ?
C2J C1J C6J 118.0(11) . . ?
C2J C1J P4 121.8(9) . . ?
C6J C1J P4 119.9(9) . . ?
C3J C2J C1J 122.1(13) . . ?
C4J C3J C2J 118.7(14) . . ?
C3J C4J C5J 123.9(15) . . ?
C4J C5J C6J 117.5(14) . . ?
C1J C6J C5J 119.8(12) . . ?
C6K C1K C2K 120.7(12) . . ?
C6K C1K P5 119.6(10) . . ?
C2K C1K P5 119.7(10) . . ?
C1K C2K C3K 117.1(14) . . ?
C4K C3K C2K 121.4(14) . . ?
C3K C4K C5K 120.6(14) . . ?
C4K C5K C6K 120.3(16) . . ?
C1K C6K C5K 119.8(14) . . ?
C2L C1L C6L 119.1(12) . . ?
C2L C1L P5 121.5(10) . . ?
C6L C1L P5 119.4(10) . . ?
C1L C2L C3L 120.6(13) . . ?
C4L C3L C2L 121.1(15) . . ?
C3L C4L C5L 119.1(15) . . ?
C6L C5L C4L 120.1(14) . . ?
C5L C6L C1L 119.9(14) . . ?
C6M C1M C2M 118.7(12) . . ?
C6M C1M P6 120.4(9) . . ?
C2M C1M P6 120.7(11) . . ?
C1M C2M C3M 118.6(15) . . ?
C4M C3M C2M 121.4(14) . . ?
C3M C4M C5M 119.7(14) . . ?
C6M C5M C4M 118.1(15) . . ?
C1M C6M C5M 123.4(13) . . ?
C2N C1N C6N 117.9(13) . . ?
C2N C1N P6 123.7(10) . . ?
C6N C1N P6 118.3(10) . . ?
C1N C2N C3N 121.2(14) . . ?
C4N C3N C2N 120.0(16) . . ?
C5N C4N C3N 117.6(16) . . ?
C6N C5N C4N 123.5(16) . . ?
C5N C6N C1N 119.6(14) . . ?
C6O C1O C2O 118.6(12) . . ?
C6O C1O P7 120.5(10) . . ?
C2O C1O P7 120.8(10) . . ?
C3O C2O C1O 121.2(13) . . ?
C2O C3O C4O 120.0(13) . . ?
C5O C4O C3O 118.0(13) . . ?
C4O C5O C6O 121.4(14) . . ?
C5O C6O C1O 120.6(14) . . ?
C6P C1P C2P 118.8(12) . . ?
C6P C1P P7 119.9(10) . . ?
C2P C1P P7 121.2(9) . . ?
C3P C2P C1P 120.6(13) . . ?
C2P C3P C4P 119.6(14) . . ?
C5P C4P C3P 120.6(15) . . ?
C4P C5P C6P 121.0(16) . . ?
C1P C6P C5P 119.3(14) . . ?
C2Q C1Q C6Q 120.1(12) . . ?
C2Q C1Q P8 118.0(10) . . ?
C6Q C1Q P8 121.9(10) . . ?
C1Q C2Q C3Q 117.5(13) . . ?
C4Q C3Q C2Q 119.8(14) . . ?
C5Q C4Q C3Q 120.7(16) . . ?
C4Q C5Q C6Q 122.3(16) . . ?
C1Q C6Q C5Q 119.4(14) . . ?
C2R C1R C6R 117.1(13) . . ?
C2R C1R P8 121.1(10) . . ?
C6R C1R P8 121.6(10) . . ?
C3R C2R C1R 119.7(13) . . ?
C4R C3R C2R 121.6(15) . . ?
C3R C4R C5R 119.9(15) . . ?
C6R C5R C4R 119.3(18) . . ?
C5R C6R C1R 122.1(15) . . ?
F1 P9 F6 95.5(11) . . ?
F1 P9 F4 92.6(7) . . ?
F6 P9 F4 90.4(9) . . ?
F1 P9 F2 90.0(7) . . ?
F6 P9 F2 89.1(9) . . ?
F4 P9 F2 177.4(7) . . ?
F1 P9 F5 90.2(9) . . ?
F6 P9 F5 173.9(11) . . ?
F4 P9 F5 91.3(8) . . ?
F2 P9 F5 89.0(8) . . ?
F1 P9 F3 178.4(11) . . ?
F6 P9 F3 86.0(10) . . ?
F4 P9 F3 87.1(7) . . ?
F2 P9 F3 90.3(7) . . ?
F5 P9 F3 88.2(9) . . ?
F11 P10 F7 89.7(6) . . ?
F11 P10 F12 179.1(7) . . ?
F7 P10 F12 90.8(6) . . ?
F11 P10 F8 91.3(8) . . ?
F7 P10 F8 90.9(6) . . ?
F12 P10 F8 89.3(7) . . ?
F11 P10 F9 92.0(6) . . ?
F7 P10 F9 178.2(6) . . ?
F12 P10 F9 87.4(6) . . ?
F8 P10 F9 89.7(6) . . ?
F11 P10 F10 90.1(7) . . ?
F7 P10 F10 90.0(6) . . ?
F12 P10 F10 89.3(6) . . ?
F8 P10 F10 178.3(7) . . ?
F9 P10 F10 89.4(6) . . ?
F18 P11 F15 93.1(8) . . ?
F18 P11 F17 177.4(7) . . ?
F15 P11 F17 89.0(7) . . ?
F18 P11 F13 87.7(7) . . ?
F15 P11 F13 177.9(7) . . ?
F17 P11 F13 90.2(7) . . ?
F18 P11 F14 93.1(6) . . ?
F15 P11 F14 92.2(6) . . ?
F17 P11 F14 85.3(6) . . ?
F13 P11 F14 89.7(5) . . ?
F18 P11 F16 88.2(5) . . ?
F15 P11 F16 87.8(6) . . ?
F17 P11 F16 93.4(6) . . ?
F13 P11 F16 90.3(5) . . ?
F14 P11 F16 178.7(6) . . ?
F21 P12 F21 180(2) 2_566 . ?
F21 P12 F20 87.2(12) 2_566 2_566 ?
F21 P12 F20 92.8(12) . 2_566 ?
F21 P12 F20 92.8(12) 2_566 . ?
F21 P12 F20 87.2(12) . . ?
F20 P12 F20 180.0(18) 2_566 . ?
F21 P12 F19 89.0(7) 2_566 2_566 ?
F21 P12 F19 91.0(7) . 2_566 ?
F20 P12 F19 84.6(8) 2_566 2_566 ?
F20 P12 F19 95.4(8) . 2_566 ?
F21 P12 F19 91.0(7) 2_566 . ?
F21 P12 F19 89.0(7) . . ?
F20 P12 F19 95.4(8) 2_566 . ?
F20 P12 F19 84.6(8) . . ?
F19 P12 F19 179.998(4) 2_566 . ?
F23 P13 F23 179.994(9) . 2_767 ?
F23 P13 F22 89.6(12) . . ?
F23 P13 F22 90.4(12) 2_767 . ?
F23 P13 F22 90.4(12) . 2_767 ?
F23 P13 F22 89.6(12) 2_767 2_767 ?
F22 P13 F22 180(2) . 2_767 ?
F23 P13 F24 85.6(8) . . ?
F23 P13 F24 94.4(8) 2_767 . ?
F22 P13 F24 89.2(7) . . ?
F22 P13 F24 90.8(7) 2_767 . ?
F23 P13 F24 94.4(8) . 2_767 ?
F23 P13 F24 85.6(8) 2_767 2_767 ?
F22 P13 F24 90.8(7) . 2_767 ?
F22 P13 F24 89.2(7) 2_767 2_767 ?
F24 P13 F24 180.0(6) . 2_767 ?
Cl1B C1S Cl1A 115.4(11) . . ?
Cl2B C2S Cl2A 112.7(10) . . ?
Cl3B C3S Cl3A 101.4(12) . . ?
Cl4A C4S Cl4B 94.2(12) . . ?
Cl5B C5S Cl5A 106.3(12) . . ?
Cl6B C6S Cl6A 91.4(10) . . ?
Cl7A C7SA Cl7B 111.1(13) . . ?
Cl7C C7SB Cl7D 117.2(18) . . ?
Cl8A C8SA Cl8B 104(2) . . ?
Cl8C C8SB Cl8D 105.9(16) . . ?
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
Pt1 P1 2.284(3) . ?
Pt1 P2 2.287(3) . ?
Pt1 S1 2.370(3) . ?
Pt1 S2 2.373(3) . ?
Pt2 P3 2.268(3) . ?
Pt2 P4 2.272(3) . ?
Pt2 S1 2.360(3) . ?
Pt2 S2 2.376(3) . ?
Pt3 P6 2.277(3) . ?
Pt3 P5 2.294(3) . ?
Pt3 S3 2.375(3) . ?
Pt3 S4 2.378(3) . ?
Pt4 P7 2.269(3) . ?
Pt4 P8 2.270(3) . ?
Pt4 S4 2.371(3) . ?
Pt4 S3 2.382(3) . ?
P1 C1B 1.792(12) . ?
P1 C15 1.815(11) . ?
P1 C1A 1.827(11) . ?
P2 C17 1.810(11) . ?
P2 C1D 1.816(12) . ?
P2 C1C 1.824(11) . ?
P3 C1E 1.800(12) . ?
P3 C1F 1.812(12) . ?
P3 C18 1.835(11) . ?
P4 C1I 1.789(13) . ?
P4 C20 1.797(12) . ?
P4 C1J 1.807(11) . ?
P5 C35 1.808(11) . ?
P5 C1L 1.813(12) . ?
P5 C1K 1.826(11) . ?
P6 C1M 1.777(12) . ?
P6 C37 1.816(12) . ?
P6 C1N 1.824(14) . ?
P7 C1P 1.794(13) . ?
P7 C1O 1.807(12) . ?
P7 C38 1.843(11) . ?
P8 C1R 1.785(13) . ?
P8 C40 1.797(13) . ?
P8 C1Q 1.813(12) . ?
S1 C1 1.835(12) . ?
S2 C8 1.830(11) . ?
S3 C21 1.847(11) . ?
S4 C28 1.830(12) . ?
C1 C2 1.495(17) . ?
C2 C3 1.363(17) . ?
C2 C7 1.367(19) . ?
C3 C4 1.343(19) . ?
C4 C5 1.34(2) . ?
C5 C6 1.30(2) . ?
C6 C7 1.35(2) . ?
C8 C9 1.491(15) . ?
C9 C10 1.376(16) . ?
C9 C14 1.385(17) . ?
C10 C11 1.380(17) . ?
C11 C12 1.345(19) . ?
C12 C13 1.42(2) . ?
C13 C14 1.332(19) . ?
C15 C16 1.515(16) . ?
C16 C17 1.524(16) . ?
C18 C19 1.531(17) . ?
C19 C20 1.521(17) . ?
C21 C22 1.483(16) . ?
C22 C23 1.335(17) . ?
C22 C27 1.377(17) . ?
C23 C24 1.379(18) . ?
C24 C25 1.36(2) . ?
C25 C26 1.32(2) . ?
C26 C27 1.38(2) . ?
C28 C29 1.502(16) . ?
C29 C30 1.366(17) . ?
C29 C34 1.398(17) . ?
C30 C31 1.361(18) . ?
C31 C32 1.31(2) . ?
C32 C33 1.44(2) . ?
C33 C34 1.342(19) . ?
C35 C36 1.515(17) . ?
C36 C37 1.536(17) . ?
C38 C39 1.535(19) . ?
C39 C40 1.540(18) . ?
C1A C6A 1.375(17) . ?
C1A C2A 1.377(17) . ?
C2A C3A 1.39(2) . ?
C3A C4A 1.40(2) . ?
C4A C5A 1.34(2) . ?
C5A C6A 1.406(18) . ?
C1B C2B 1.365(19) . ?
C1B C6B 1.376(16) . ?
C2B C3B 1.39(2) . ?
C3B C4B 1.35(2) . ?
C4B C5B 1.33(2) . ?
C5B C6B 1.451(19) . ?
C1C C6C 1.359(15) . ?
C1C C2C 1.373(16) . ?
C2C C3C 1.373(18) . ?
C3C C4C 1.37(2) . ?
C4C C5C 1.37(2) . ?
C5C C6C 1.410(18) . ?
C1D C2D 1.364(17) . ?
C1D C6D 1.376(16) . ?
C2D C3D 1.421(18) . ?
C3D C4D 1.38(2) . ?
C4D C5D 1.32(2) . ?
C5D C6D 1.387(18) . ?
C1E C6E 1.394(17) . ?
C1E C2E 1.408(16) . ?
C2E C3E 1.354(17) . ?
C3E C4E 1.38(2) . ?
C4E C5E 1.34(2) . ?
C5E C6E 1.374(19) . ?
C1F C6F 1.365(18) . ?
C1F C2F 1.404(16) . ?
C2F C3F 1.376(18) . ?
C3F C4F 1.44(2) . ?
C4F C5F 1.37(2) . ?
C5F C6F 1.397(19) . ?
C1I C6I 1.397(16) . ?
C1I C2I 1.409(18) . ?
C2I C3I 1.38(2) . ?
C3I C4I 1.39(2) . ?
C4I C5I 1.34(2) . ?
C5I C6I 1.367(18) . ?
C1J C2J 1.379(16) . ?
C1J C6J 1.392(15) . ?
C2J C3J 1.372(18) . ?
C3J C4J 1.32(2) . ?
C4J C5J 1.36(2) . ?
C5J C6J 1.416(17) . ?
C1K C6K 1.333(17) . ?
C1K C2K 1.384(16) . ?
C2K C3K 1.396(18) . ?
C3K C4K 1.32(2) . ?
C4K C5K 1.33(2) . ?
C5K C6K 1.384(19) . ?
C1L C2L 1.366(16) . ?
C1L C6L 1.387(17) . ?
C2L C3L 1.381(18) . ?
C3L C4L 1.35(2) . ?
C4L C5L 1.39(2) . ?
C5L C6L 1.384(18) . ?
C1M C6M 1.360(18) . ?
C1M C2M 1.395(17) . ?
C2M C3M 1.41(2) . ?
C3M C4M 1.36(2) . ?
C4M C5M 1.40(2) . ?
C5M C6M 1.374(19) . ?
C1N C2N 1.338(17) . ?
C1N C6N 1.413(17) . ?
C2N C3N 1.39(2) . ?
C3N C4N 1.37(2) . ?
C4N C5N 1.35(2) . ?
C5N C6N 1.329(19) . ?
C1O C6O 1.379(17) . ?
C1O C2O 1.381(16) . ?
C2O C3O 1.366(18) . ?
C3O C4O 1.411(19) . ?
C4O C5O 1.37(2) . ?
C5O C6O 1.372(19) . ?
C1P C6P 1.371(17) . ?
C1P C2P 1.394(17) . ?
C2P C3P 1.369(18) . ?
C3P C4P 1.39(2) . ?
C4P C5P 1.31(2) . ?
C5P C6P 1.42(2) . ?
C1Q C2Q 1.368(16) . ?
C1Q C6Q 1.381(16) . ?
C2Q C3Q 1.449(19) . ?
C3Q C4Q 1.36(2) . ?
C4Q C5Q 1.30(2) . ?
C5Q C6Q 1.384(19) . ?
C1R C2R 1.416(16) . ?
C1R C6R 1.416(18) . ?
C2R C3R 1.378(18) . ?
C3R C4R 1.36(2) . ?
C4R C5R 1.41(2) . ?
C5R C6R 1.35(2) . ?
P9 F1 1.487(12) . ?
P9 F6 1.499(13) . ?
P9 F4 1.526(10) . ?
P9 F2 1.533(10) . ?
P9 F5 1.561(13) . ?
P9 F3 1.584(12) . ?
P10 F11 1.549(9) . ?
P10 F7 1.571(9) . ?
P10 F12 1.572(11) . ?
P10 F8 1.576(10) . ?
P10 F9 1.580(9) . ?
P10 F10 1.587(9) . ?
P11 F18 1.528(9) . ?
P11 F15 1.538(10) . ?
P11 F17 1.545(10) . ?
P11 F13 1.559(9) . ?
P11 F14 1.559(9) . ?
P11 F16 1.573(9) . ?
P12 F21 1.476(13) 2_566 ?
P12 F21 1.476(13) . ?
P12 F20 1.490(14) 2_566 ?
P12 F20 1.490(14) . ?
P12 F19 1.577(11) 2_566 ?
P12 F19 1.577(11) . ?
P13 F23 1.491(13) . ?
P13 F23 1.491(13) 2_767 ?
P13 F22 1.502(11) . ?
P13 F22 1.502(11) 2_767 ?
P13 F24 1.568(11) . ?
P13 F24 1.568(11) 2_767 ?
C1S Cl1B 1.630(14) . ?
C1S Cl1A 1.665(15) . ?
C2S Cl2B 1.668(15) . ?
C2S Cl2A 1.713(14) . ?
C3S Cl3B 1.684(17) . ?
C3S Cl3A 1.707(17) . ?
C4S Cl4A 1.702(17) . ?
C4S Cl4B 1.803(16) . ?
C5S Cl5B 1.773(17) . ?
C5S Cl5A 1.786(17) . ?
C6S Cl6B 1.706(15) . ?
C6S Cl6A 1.774(15) . ?
C7SA Cl7A 1.749(19) . ?
C7SA Cl7B 1.759(19) . ?
C7SB Cl7C 1.711(19) . ?
C7SB Cl7D 1.743(19) . ?
C8SA Cl8A 1.74(2) . ?
C8SA Cl8B 1.74(2) . ?
C8SB Cl8C 1.73(2) . ?
C8SB Cl8D 1.73(2) . ?
