#------------------------------------------------------------------------------
#$Date: 2016-03-25 10:50:02 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179766 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/62/7006266.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_7006266
loop_
_publ_author_name
'Vuzman, Dana'
'Poverenov, Elena'
'Diskin-Posner, Yael'
'Leitus, Gregory'
'Shimon, Linda J. W.'
'Milstein, David'
_publ_section_title
;
 Reactivity and stability of platinum(II) formyl complexes based on
 PCP-type ligands. The significance of sterics.
;
_journal_issue                   48
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5692
_journal_page_last               5700
_journal_paper_doi               10.1039/b711444c
_journal_year                    2007
_chemical_formula_moiety         'C25 H43 O P2 Pt, B F4'
_chemical_formula_sum            'C25 H43 B F4 O P2 Pt'
_chemical_formula_weight         703.43
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 92.5884(6)
_cell_angle_gamma                90.00
_cell_formula_units_Z            12
_cell_length_a                   14.7910(2)
_cell_length_b                   26.9261(4)
_cell_length_c                   21.0591(4)
_cell_measurement_reflns_used    14469
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      2.55
_cell_volume                     8378.5(2)
_computing_cell_refinement       HKL
_computing_data_collection       'Collect package Bruker - Nonius'
_computing_data_reduction        HKL
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      120(2)
_diffrn_measured_fraction_theta_full 0.989
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device_type  'Nonius Kappa CCD'
_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  0.0630
_diffrn_reflns_av_sigmaI/netI    0.0936
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       35
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            48040
_diffrn_reflns_theta_full        28.27
_diffrn_reflns_theta_max         28.27
_diffrn_reflns_theta_min         1.23
_exptl_absorpt_coefficient_mu    5.182
_exptl_absorpt_correction_T_max  0.1815
_exptl_absorpt_correction_T_min  0.0178
_exptl_absorpt_correction_type   analytical
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.673
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'Leaf shape'
_exptl_crystal_F_000             4200
_exptl_crystal_size_max          0.5
_exptl_crystal_size_mid          0.4
_exptl_crystal_size_min          0.1
_refine_diff_density_max         4.097
_refine_diff_density_min         -3.182
_refine_diff_density_rms         0.250
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.982
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     926
_refine_ls_number_reflns         20527
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.982
_refine_ls_R_factor_all          0.1009
_refine_ls_R_factor_gt           0.0567
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0823P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1287
_refine_ls_wR_factor_ref         0.1491
_reflns_number_gt                13643
_reflns_number_total             20527
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b711444c.txt
_cod_data_source_block           m755
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Analytical' changed
to 'analytical' 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 
;
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               7006266
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'
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 0.045955(17) 0.627574(11) 0.635072(12) 0.01653(8) Uani 1 1 d . . .
P2 P 0.16036(11) 0.67224(8) 0.58927(8) 0.0173(4) Uani 1 1 d . . .
P3 P -0.09185(12) 0.59659(8) 0.66613(9) 0.0202(4) Uani 1 1 d . . .
C4 C -0.1678(5) 0.6498(3) 0.6534(4) 0.0236(17) Uani 1 1 d . . .
H4A H -0.2263 0.6384 0.6339 0.028 Uiso 1 1 calc R . .
H4B H -0.1794 0.6657 0.6946 0.028 Uiso 1 1 calc R . .
C5 C -0.1256(5) 0.6868(3) 0.6105(3) 0.0238(17) Uani 1 1 d . . .
C6 C -0.1772(4) 0.7277(3) 0.5884(3) 0.0211(16) Uani 1 1 d . . .
H6 H -0.2388 0.7303 0.5990 0.025 Uiso 1 1 calc R . .
C7 C -0.1401(4) 0.7637(3) 0.5516(3) 0.0239(17) Uani 1 1 d . . .
H7 H -0.1758 0.7911 0.5370 0.029 Uiso 1 1 calc R . .
C8 C -0.0495(4) 0.7602(3) 0.5356(3) 0.0204(16) Uani 1 1 d . . .
H8 H -0.0233 0.7854 0.5106 0.025 Uiso 1 1 calc R . .
C9 C 0.0021(4) 0.7197(3) 0.5564(3) 0.0213(17) Uani 1 1 d . . .
C10 C -0.0342(4) 0.6828(3) 0.5957(3) 0.0162(15) Uani 1 1 d . . .
C11 C 0.0984(4) 0.7140(3) 0.5351(3) 0.0252(18) Uani 1 1 d . . .
H11A H 0.1286 0.7468 0.5349 0.030 Uiso 1 1 calc R . .
H11B H 0.0975 0.7003 0.4914 0.030 Uiso 1 1 calc R . .
C12 C 0.2239(4) 0.7121(3) 0.6477(3) 0.0210(16) Uani 1 1 d . . .
C13 C 0.1534(4) 0.7477(3) 0.6755(4) 0.0264(18) Uani 1 1 d . . .
H13A H 0.1076 0.7284 0.6969 0.040 Uiso 1 1 calc R . .
H13B H 0.1241 0.7672 0.6410 0.040 Uiso 1 1 calc R . .
H13C H 0.1839 0.7702 0.7061 0.040 Uiso 1 1 calc R . .
C14 C 0.2647(5) 0.6811(3) 0.7035(3) 0.031(2) Uani 1 1 d . . .
H14A H 0.3078 0.6570 0.6874 0.046 Uiso 1 1 calc R . .
H14B H 0.2162 0.6634 0.7243 0.046 Uiso 1 1 calc R . .
H14C H 0.2961 0.7031 0.7343 0.046 Uiso 1 1 calc R . .
C15 C 0.2992(5) 0.7420(3) 0.6177(4) 0.0308(19) Uani 1 1 d . . .
H15A H 0.3249 0.7657 0.6489 0.046 Uiso 1 1 calc R . .
H15B H 0.2741 0.7601 0.5805 0.046 Uiso 1 1 calc R . .
H15C H 0.3467 0.7194 0.6045 0.046 Uiso 1 1 calc R . .
C16 C 0.2322(4) 0.6342(3) 0.5366(3) 0.0213(17) Uani 1 1 d . . .
C17 C 0.1675(5) 0.6010(3) 0.4962(4) 0.035(2) Uani 1 1 d . . .
H17A H 0.2021 0.5819 0.4660 0.053 Uiso 1 1 calc R . .
H17B H 0.1229 0.6218 0.4729 0.053 Uiso 1 1 calc R . .
H17C H 0.1362 0.5781 0.5241 0.053 Uiso 1 1 calc R . .
C18 C 0.2863(5) 0.6680(3) 0.4917(4) 0.032(2) Uani 1 1 d . . .
H18A H 0.3356 0.6844 0.5162 0.048 Uiso 1 1 calc R . .
H18B H 0.2458 0.6932 0.4724 0.048 Uiso 1 1 calc R . .
H18C H 0.3115 0.6477 0.4582 0.048 Uiso 1 1 calc R . .
C19 C 0.2973(5) 0.6012(3) 0.5753(4) 0.032(2) Uani 1 1 d . . .
H19A H 0.2631 0.5801 0.6037 0.047 Uiso 1 1 calc R . .
H19B H 0.3397 0.6219 0.6007 0.047 Uiso 1 1 calc R . .
H19C H 0.3310 0.5802 0.5466 0.047 Uiso 1 1 calc R . .
C20 C -0.0965(5) 0.5821(3) 0.7525(3) 0.0263(18) Uani 1 1 d . . .
C21 C -0.0534(5) 0.5322(3) 0.7702(4) 0.035(2) Uani 1 1 d . . .
H21A H -0.0511 0.5283 0.8165 0.052 Uiso 1 1 calc R . .
H21B H 0.0081 0.5309 0.7549 0.052 Uiso 1 1 calc R . .
H21C H -0.0896 0.5053 0.7506 0.052 Uiso 1 1 calc R . .
C22 C -0.1939(5) 0.5828(4) 0.7749(4) 0.043(3) Uani 1 1 d . . .
H22A H -0.2268 0.5539 0.7575 0.064 Uiso 1 1 calc R . .
H22B H -0.2242 0.6133 0.7600 0.064 Uiso 1 1 calc R . .
H22C H -0.1928 0.5816 0.8214 0.064 Uiso 1 1 calc R . .
C23 C -0.0427(6) 0.6238(4) 0.7867(4) 0.042(2) Uani 1 1 d . . .
H23A H -0.0455 0.6195 0.8328 0.062 Uiso 1 1 calc R . .
H23B H -0.0689 0.6560 0.7744 0.062 Uiso 1 1 calc R . .
H23C H 0.0205 0.6225 0.7747 0.062 Uiso 1 1 calc R . .
C24 C -0.1315(5) 0.5464(3) 0.6116(4) 0.0265(18) Uani 1 1 d . . .
C25 C -0.0624(5) 0.5039(3) 0.6101(4) 0.039(2) Uani 1 1 d . . .
H25A H -0.0585 0.4873 0.6516 0.058 Uiso 1 1 calc R . .
H25B H -0.0029 0.5173 0.6006 0.058 Uiso 1 1 calc R . .
H25C H -0.0816 0.4799 0.5772 0.058 Uiso 1 1 calc R . .
C26 C -0.1432(5) 0.5692(4) 0.5447(4) 0.041(2) Uani 1 1 d . . .
H26A H -0.1620 0.5433 0.5142 0.061 Uiso 1 1 calc R . .
H26B H -0.0856 0.5835 0.5325 0.061 Uiso 1 1 calc R . .
H26C H -0.1894 0.5952 0.5447 0.061 Uiso 1 1 calc R . .
C27 C -0.2234(5) 0.5244(3) 0.6293(4) 0.037(2) Uani 1 1 d . . .
H27A H -0.2460 0.5021 0.5953 0.055 Uiso 1 1 calc R . .
H27B H -0.2669 0.5513 0.6347 0.055 Uiso 1 1 calc R . .
H27C H -0.2157 0.5057 0.6691 0.055 Uiso 1 1 calc R . .
C28 C 0.1234(4) 0.5812(3) 0.6811(3) 0.0239(18) Uani 1 1 d . . .
O29 O 0.1677(3) 0.5561(2) 0.7110(2) 0.0337(15) Uani 1 1 d . . .
Pt30 Pt 0.305366(16) 0.390218(12) 0.694506(12) 0.01738(8) Uani 1 1 d . . .
P31 P 0.44575(11) 0.42570(8) 0.67853(9) 0.0183(4) Uani 1 1 d . . .
P32 P 0.18530(11) 0.33853(8) 0.71565(9) 0.0200(4) Uani 1 1 d . A .
C33 C 0.2402(5) 0.2830(3) 0.7480(5) 0.045(3) Uani 1 1 d . . .
H33A H 0.2181 0.2762 0.7908 0.055 Uiso 1 1 calc R . .
H33B H 0.2242 0.2542 0.7205 0.055 Uiso 1 1 calc R . .
C34 C 0.3420(5) 0.2890(3) 0.7525(3) 0.0237(17) Uani 1 1 d . . .
C35 C 0.3935(5) 0.2495(3) 0.7757(3) 0.0248(17) Uani 1 1 d . . .
H35 H 0.3648 0.2205 0.7907 0.030 Uiso 1 1 calc R . .
C36 C 0.4878(5) 0.2524(3) 0.7772(3) 0.0277(18) Uani 1 1 d . . .
H36 H 0.5234 0.2252 0.7924 0.033 Uiso 1 1 calc R . .
C37 C 0.5294(5) 0.2954(3) 0.7563(3) 0.0266(19) Uani 1 1 d . . .
H37 H 0.5936 0.2972 0.7570 0.032 Uiso 1 1 calc R . .
C38 C 0.4783(5) 0.3354(3) 0.7346(3) 0.0230(17) Uani 1 1 d . . .
C39 C 0.3824(4) 0.3325(3) 0.7319(3) 0.0187(16) Uani 1 1 d . . .
C40 C 0.5259(4) 0.3826(3) 0.7176(3) 0.0262(19) Uani 1 1 d . . .
H40A H 0.5752 0.3750 0.6887 0.031 Uiso 1 1 calc R . .
H40B H 0.5532 0.3981 0.7565 0.031 Uiso 1 1 calc R . .
C41 C 0.4685(5) 0.4265(3) 0.5922(3) 0.0249(17) Uani 1 1 d . . .
C42 C 0.4764(5) 0.3709(3) 0.5721(4) 0.035(2) Uani 1 1 d . . .
H42A H 0.4818 0.3689 0.5259 0.052 Uiso 1 1 calc R . .
H42B H 0.4222 0.3529 0.5841 0.052 Uiso 1 1 calc R . .
H42C H 0.5300 0.3561 0.5935 0.052 Uiso 1 1 calc R . .
C43 C 0.5558(5) 0.4533(4) 0.5774(4) 0.040(2) Uani 1 1 d . . .
H43A H 0.5681 0.4487 0.5324 0.060 Uiso 1 1 calc R . .
H43B H 0.6060 0.4397 0.6038 0.060 Uiso 1 1 calc R . .
H43C H 0.5493 0.4888 0.5863 0.060 Uiso 1 1 calc R . .
C44 C 0.3902(5) 0.4495(3) 0.5529(3) 0.035(2) Uani 1 1 d . . .
H44A H 0.3793 0.4833 0.5681 0.052 Uiso 1 1 calc R . .
H44B H 0.3356 0.4294 0.5573 0.052 Uiso 1 1 calc R . .
H44C H 0.4053 0.4506 0.5081 0.052 Uiso 1 1 calc R . .
C45 C 0.4658(4) 0.4862(3) 0.7206(3) 0.0242(18) Uani 1 1 d . . .
C46 C 0.4124(5) 0.5281(3) 0.6886(4) 0.034(2) Uani 1 1 d . . .
H46A H 0.4158 0.5576 0.7157 0.051 Uiso 1 1 calc R . .
H46B H 0.3491 0.5179 0.6818 0.051 Uiso 1 1 calc R . .
H46C H 0.4380 0.5356 0.6476 0.051 Uiso 1 1 calc R . .
C47 C 0.4323(5) 0.4789(4) 0.7879(4) 0.039(2) Uani 1 1 d . . .
H47A H 0.4419 0.5096 0.8124 0.059 Uiso 1 1 calc R . .
H47B H 0.4660 0.4518 0.8089 0.059 Uiso 1 1 calc R . .
H47C H 0.3677 0.4708 0.7854 0.059 Uiso 1 1 calc R . .
C48 C 0.5672(5) 0.4999(4) 0.7253(4) 0.034(2) Uani 1 1 d . . .
H48A H 0.5890 0.5049 0.6826 0.052 Uiso 1 1 calc R . .
H48B H 0.6014 0.4729 0.7464 0.052 Uiso 1 1 calc R . .
H48C H 0.5755 0.5305 0.7500 0.052 Uiso 1 1 calc R . .
C49 C 0.1257(5) 0.3160(3) 0.6410(4) 0.031(2) Uani 1 1 d . . .
C50 C 0.0614(5) 0.2734(4) 0.6509(4) 0.052(3) Uani 1 1 d . A .
H50A H 0.0359 0.2621 0.6097 0.077 Uiso 1 1 calc R . .
H50B H 0.0124 0.2846 0.6773 0.077 Uiso 1 1 calc R . .
H50C H 0.0941 0.2460 0.6722 0.077 Uiso 1 1 calc R . .
C51A C 0.0548(18) 0.3615(9) 0.6149(12) 0.036(6) Uani 0.47(4) 1 d P A 1
H51A H 0.0884 0.3928 0.6123 0.053 Uiso 0.47(4) 1 calc PR A 1
H51B H 0.0060 0.3654 0.6445 0.053 Uiso 0.47(4) 1 calc PR A 1
H51C H 0.0288 0.3529 0.5727 0.053 Uiso 0.47(4) 1 calc PR A 1
C52A C 0.1937(13) 0.3095(10) 0.5892(10) 0.035(7) Uani 0.53(4) 1 d P A 1
H52A H 0.2368 0.2832 0.6016 0.053 Uiso 0.53(4) 1 calc PR A 1
H52B H 0.2265 0.3407 0.5836 0.053 Uiso 0.53(4) 1 calc PR A 1
H52C H 0.1616 0.3004 0.5492 0.053 Uiso 0.53(4) 1 calc PR A 1
C51B C 0.089(2) 0.3534(11) 0.6020(12) 0.057(8) Uiso 0.53(4) 1 d P A 2
H51D H 0.0588 0.3385 0.5643 0.086 Uiso 0.53(4) 1 calc PR A 2
H51E H 0.1376 0.3754 0.5889 0.086 Uiso 0.53(4) 1 calc PR A 2
H51F H 0.0451 0.3725 0.6254 0.086 Uiso 0.53(4) 1 calc PR A 2
C52B C 0.2069(16) 0.2852(14) 0.6101(15) 0.057(8) Uiso 0.47(4) 1 d P A 2
H52D H 0.2272 0.2587 0.6393 0.086 Uiso 0.47(4) 1 calc PR A 2
H52E H 0.2575 0.3076 0.6028 0.086 Uiso 0.47(4) 1 calc PR A 2
H52F H 0.1851 0.2706 0.5696 0.086 Uiso 0.47(4) 1 calc PR A 2
C53 C 0.1132(5) 0.3632(3) 0.7782(3) 0.0272(18) Uani 1 1 d . . .
C54 C 0.0416(5) 0.3253(3) 0.7986(4) 0.037(2) Uani 1 1 d . A .
H54A H 0.0170 0.3359 0.8388 0.056 Uiso 1 1 calc R . .
H54B H 0.0697 0.2925 0.8041 0.056 Uiso 1 1 calc R . .
H54C H -0.0074 0.3234 0.7658 0.056 Uiso 1 1 calc R . .
C55 C 0.1794(6) 0.3735(4) 0.8353(4) 0.063(4) Uani 1 1 d . A .
H55A H 0.2290 0.3945 0.8218 0.094 Uiso 1 1 calc R . .
H55B H 0.2039 0.3420 0.8518 0.094 Uiso 1 1 calc R . .
H55C H 0.1473 0.3905 0.8688 0.094 Uiso 1 1 calc R . .
C56 C 0.0669(6) 0.4111(3) 0.7576(5) 0.052(3) Uani 1 1 d . A .
H56A H 0.0352 0.4251 0.7934 0.078 Uiso 1 1 calc R . .
H56B H 0.0232 0.4044 0.7223 0.078 Uiso 1 1 calc R . .
H56C H 0.1122 0.4349 0.7438 0.078 Uiso 1 1 calc R . .
C57 C 0.2331(4) 0.4429(3) 0.6550(3) 0.0266(19) Uani 1 1 d . . .
O58 O 0.1923(3) 0.4718(2) 0.6299(3) 0.0325(14) Uani 1 1 d . . .
Pt59 Pt 0.632312(16) 0.379371(12) 1.022992(12) 0.01852(8) Uani 1 1 d . . .
P60 P 0.51412(11) 0.33103(8) 1.05704(8) 0.0184(4) Uani 1 1 d . . .
P61 P 0.77134(12) 0.41728(8) 1.00765(9) 0.0212(4) Uani 1 1 d . . .
C62 C 0.8529(4) 0.3695(3) 1.0345(4) 0.029(2) Uani 1 1 d . . .
H62A H 0.8787 0.3533 0.9973 0.035 Uiso 1 1 calc R . .
H62B H 0.9030 0.3851 1.0602 0.035 Uiso 1 1 calc R . .
C63 C 0.8072(4) 0.3320(3) 1.0733(3) 0.0222(17) Uani 1 1 d . . .
C64 C 0.8581(5) 0.2979(3) 1.1098(3) 0.0237(17) Uani 1 1 d . . .
H64 H 0.9221 0.3012 1.1124 0.028 Uiso 1 1 calc R . .
C65 C 0.8187(5) 0.2598(3) 1.1423(3) 0.0246(17) Uani 1 1 d . . .
H65 H 0.8552 0.2380 1.1679 0.030 Uiso 1 1 calc R . .
C66 C 0.7258(4) 0.2535(3) 1.1375(3) 0.0237(17) Uani 1 1 d . . .
H66 H 0.6984 0.2265 1.1584 0.028 Uiso 1 1 calc R . .
C67 C 0.6722(4) 0.2874(3) 1.1015(3) 0.0183(15) Uani 1 1 d . . .
C68 C 0.7117(4) 0.3272(3) 1.0697(3) 0.0176(15) Uani 1 1 d . . .
C69 C 0.5719(4) 0.2770(3) 1.0938(4) 0.030(2) Uani 1 1 d . . .
H69A H 0.5472 0.2702 1.1358 0.036 Uiso 1 1 calc R . .
H69B H 0.5615 0.2473 1.0667 0.036 Uiso 1 1 calc R . .
C70 C 0.4383(4) 0.3037(3) 0.9924(3) 0.0244(18) Uani 1 1 d . . .
C71 C 0.3806(5) 0.2611(3) 1.0170(4) 0.034(2) Uani 1 1 d . . .
H71A H 0.3335 0.2746 1.0433 0.051 Uiso 1 1 calc R . .
H71B H 0.4191 0.2383 1.0424 0.051 Uiso 1 1 calc R . .
H71C H 0.3522 0.2431 0.9809 0.051 Uiso 1 1 calc R . .
C72 C 0.5022(5) 0.2836(4) 0.9426(4) 0.055(3) Uani 1 1 d . . .
H72A H 0.5422 0.2583 0.9622 0.083 Uiso 1 1 calc R . .
H72B H 0.5387 0.3108 0.9266 0.083 Uiso 1 1 calc R . .
H72C H 0.4663 0.2687 0.9072 0.083 Uiso 1 1 calc R . .
C73 C 0.3772(5) 0.3429(4) 0.9608(4) 0.038(2) Uani 1 1 d . . .
H73A H 0.3399 0.3276 0.9265 0.058 Uiso 1 1 calc R . .
H73B H 0.4144 0.3693 0.9433 0.058 Uiso 1 1 calc R . .
H73C H 0.3378 0.3572 0.9923 0.058 Uiso 1 1 calc R . .
C74 C 0.4526(5) 0.3622(3) 1.1220(3) 0.0214(16) Uani 1 1 d . . .
C75 C 0.5241(5) 0.3685(3) 1.1770(3) 0.032(2) Uani 1 1 d . . .
H75A H 0.5734 0.3896 1.1630 0.048 Uiso 1 1 calc R . .
H75B H 0.5482 0.3359 1.1897 0.048 Uiso 1 1 calc R . .
H75C H 0.4961 0.3841 1.2133 0.048 Uiso 1 1 calc R . .
C76 C 0.3734(5) 0.3311(3) 1.1444(3) 0.031(2) Uani 1 1 d . . .
H76A H 0.3533 0.3444 1.1847 0.046 Uiso 1 1 calc R . .
H76B H 0.3929 0.2966 1.1505 0.046 Uiso 1 1 calc R . .
H76C H 0.3233 0.3325 1.1124 0.046 Uiso 1 1 calc R . .
C77 C 0.4201(5) 0.4131(3) 1.1009(4) 0.0307(19) Uani 1 1 d . . .
H77A H 0.3771 0.4098 1.0643 0.046 Uiso 1 1 calc R . .
H77B H 0.4720 0.4331 1.0887 0.046 Uiso 1 1 calc R . .
H77C H 0.3904 0.4295 1.1358 0.046 Uiso 1 1 calc R . .
C78 C 0.7899(5) 0.4705(3) 1.0626(4) 0.0264(18) Uani 1 1 d . . .
C79 C 0.7138(5) 0.5081(3) 1.0542(4) 0.032(2) Uani 1 1 d . . .
H79A H 0.7223 0.5346 1.0859 0.048 Uiso 1 1 calc R . .
H79B H 0.6557 0.4916 1.0598 0.048 Uiso 1 1 calc R . .
H79C H 0.7144 0.5225 1.0114 0.048 Uiso 1 1 calc R . .
C80 C 0.7887(5) 0.4495(3) 1.1308(3) 0.036(2) Uani 1 1 d . . .
H80A H 0.8370 0.4248 1.1370 0.053 Uiso 1 1 calc R . .
H80B H 0.7301 0.4338 1.1372 0.053 Uiso 1 1 calc R . .
H80C H 0.7984 0.4765 1.1615 0.053 Uiso 1 1 calc R . .
C81 C 0.8812(5) 0.4960(3) 1.0544(4) 0.036(2) Uani 1 1 d . . .
H81A H 0.8823 0.5105 1.0117 0.054 Uiso 1 1 calc R . .
H81B H 0.9300 0.4716 1.0599 0.054 Uiso 1 1 calc R . .
H81C H 0.8897 0.5223 1.0863 0.054 Uiso 1 1 calc R . .
C82 C 0.7958(5) 0.4290(3) 0.9227(3) 0.0286(19) Uani 1 1 d . . .
C83 C 0.7622(6) 0.3838(4) 0.8864(4) 0.050(3) Uani 1 1 d . . .
H83A H 0.7765 0.3872 0.8416 0.076 Uiso 1 1 calc R . .
H83B H 0.6966 0.3809 0.8897 0.076 Uiso 1 1 calc R . .
H83C H 0.7918 0.3541 0.9042 0.076 Uiso 1 1 calc R . .
C84 C 0.8963(5) 0.4367(4) 0.9124(4) 0.041(2) Uani 1 1 d . . .
H84A H 0.9063 0.4375 0.8667 0.061 Uiso 1 1 calc R . .
H84B H 0.9311 0.4094 0.9321 0.061 Uiso 1 1 calc R . .
H84C H 0.9161 0.4682 0.9318 0.061 Uiso 1 1 calc R . .
C85 C 0.7444(5) 0.4749(3) 0.8959(4) 0.036(2) Uani 1 1 d . . .
H85A H 0.7665 0.5048 0.9182 0.054 Uiso 1 1 calc R . .
H85B H 0.6795 0.4710 0.9022 0.054 Uiso 1 1 calc R . .
H85C H 0.7544 0.4781 0.8504 0.054 Uiso 1 1 calc R . .
C86 C 0.5583(5) 0.4282(3) 0.9777(4) 0.0286(19) Uani 1 1 d . . .
O87 O 0.5162(3) 0.4566(2) 0.9520(3) 0.0390(16) Uani 1 1 d . . .
B88 B 0.4334(5) 0.1319(4) 0.8767(5) 0.031(2) Uani 1 1 d . . .
F89 F 0.3935(4) 0.1240(2) 0.8175(2) 0.0500(15) Uani 1 1 d . . .
F90 F 0.4525(3) 0.08790(19) 0.9074(2) 0.0424(13) Uani 1 1 d . . .
F91 F 0.3759(4) 0.1603(3) 0.9120(3) 0.072(2) Uani 1 1 d . . .
F92 F 0.5135(4) 0.1564(3) 0.8697(3) 0.085(2) Uani 1 1 d . . .
B93 B 1.1213(6) 0.3838(4) 1.0396(4) 0.025(2) Uani 1 1 d . . .
F94 F 1.0727(3) 0.4225(2) 1.0690(2) 0.0497(14) Uiso 1 1 d . . .
F95 F 1.0852(4) 0.3791(2) 0.9790(3) 0.0594(16) Uiso 1 1 d . . .
F96 F 1.1111(4) 0.3406(2) 1.0730(3) 0.0635(17) Uiso 1 1 d . . .
F97 F 1.2081(5) 0.3972(3) 1.0392(3) 0.089(2) Uiso 1 1 d . . .
B98 B 0.7899(7) 0.3823(4) 0.6997(4) 0.033(2) Uani 1 1 d . . .
F99 F 0.8669(5) 0.3628(3) 0.6727(4) 0.104(3) Uiso 1 1 d . . .
F100 F 0.7512(4) 0.3453(2) 0.7342(3) 0.0586(16) Uiso 1 1 d . . .
F101 F 0.7330(4) 0.3944(2) 0.6500(3) 0.0609(16) Uiso 1 1 d . . .
F102 F 0.8130(4) 0.4217(3) 0.7354(3) 0.081(2) Uiso 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 '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'
B B 0.0013 0.0007 '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'
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
C28 Pt1 C10 172.7(3) . . ?
C28 Pt1 P2 96.7(2) . . ?
C10 Pt1 P2 82.87(19) . . ?
C28 Pt1 P3 97.8(2) . . ?
C10 Pt1 P3 82.84(19) . . ?
P2 Pt1 P3 165.53(7) . . ?
C11 P2 C12 106.6(4) . . ?
C11 P2 C16 104.4(3) . . ?
C12 P2 C16 115.1(3) . . ?
C11 P2 Pt1 103.0(2) . . ?
C12 P2 Pt1 112.4(2) . . ?
C16 P2 Pt1 114.0(3) . . ?
C4 P3 C24 107.8(4) . . ?
C4 P3 C20 104.9(3) . . ?
C24 P3 C20 115.3(4) . . ?
C4 P3 Pt1 102.5(2) . . ?
C24 P3 Pt1 110.2(2) . . ?
C20 P3 Pt1 114.9(2) . . ?
C5 C4 P3 109.8(5) . . ?
C5 C4 H4A 109.7 . . ?
P3 C4 H4A 109.7 . . ?
C5 C4 H4B 109.7 . . ?
P3 C4 H4B 109.7 . . ?
H4A C4 H4B 108.2 . . ?
C10 C5 C6 120.0(7) . . ?
C10 C5 C4 120.9(6) . . ?
C6 C5 C4 119.0(6) . . ?
C7 C6 C5 121.0(6) . . ?
C7 C6 H6 119.5 . . ?
C5 C6 H6 119.5 . . ?
C6 C7 C8 120.0(7) . . ?
C6 C7 H7 120.0 . . ?
C8 C7 H7 120.0 . . ?
C9 C8 C7 119.7(7) . . ?
C9 C8 H8 120.2 . . ?
C7 C8 H8 120.2 . . ?
C8 C9 C10 121.2(6) . . ?
C8 C9 C11 119.6(7) . . ?
C10 C9 C11 119.2(6) . . ?
C5 C10 C9 118.1(6) . . ?
C5 C10 Pt1 120.7(5) . . ?
C9 C10 Pt1 121.1(5) . . ?
C9 C11 P2 109.2(5) . . ?
C9 C11 H11A 109.8 . . ?
P2 C11 H11A 109.8 . . ?
C9 C11 H11B 109.8 . . ?
P2 C11 H11B 109.8 . . ?
H11A C11 H11B 108.3 . . ?
C15 C12 C14 109.4(6) . . ?
C15 C12 C13 110.0(6) . . ?
C14 C12 C13 107.1(6) . . ?
C15 C12 P2 112.7(5) . . ?
C14 C12 P2 111.2(5) . . ?
C13 C12 P2 106.2(4) . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C12 C14 H14A 109.5 . . ?
C12 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C12 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C12 C15 H15A 109.5 . . ?
C12 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C12 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C19 C16 C17 108.6(7) . . ?
C19 C16 C18 109.7(5) . . ?
C17 C16 C18 109.2(6) . . ?
C19 C16 P2 111.3(5) . . ?
C17 C16 P2 106.8(4) . . ?
C18 C16 P2 111.1(6) . . ?
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 . . ?
C16 C19 H19A 109.5 . . ?
C16 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C16 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C21 C20 C22 108.8(7) . . ?
C21 C20 C23 109.1(7) . . ?
C22 C20 C23 108.7(7) . . ?
C21 C20 P3 112.9(5) . . ?
C22 C20 P3 111.9(5) . . ?
C23 C20 P3 105.2(5) . . ?
C20 C21 H21A 109.5 . . ?
C20 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C20 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C20 C22 H22A 109.5 . . ?
C20 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C20 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C20 C23 H23A 109.5 . . ?
C20 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C20 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C25 C24 C26 109.0(7) . . ?
C25 C24 C27 108.2(7) . . ?
C26 C24 C27 108.0(6) . . ?
C25 C24 P3 111.4(5) . . ?
C26 C24 P3 107.2(6) . . ?
C27 C24 P3 112.9(6) . . ?
C24 C25 H25A 109.5 . . ?
C24 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
C24 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C24 C26 H26A 109.5 . . ?
C24 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C24 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C24 C27 H27A 109.5 . . ?
C24 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C24 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
O29 C28 Pt1 175.9(7) . . ?
C57 Pt30 C39 177.0(3) . . ?
C57 Pt30 P32 96.3(2) . . ?
C39 Pt30 P32 83.6(2) . . ?
C57 Pt30 P31 96.7(2) . . ?
C39 Pt30 P31 83.3(2) . . ?
P32 Pt30 P31 166.68(7) . . ?
C40 P31 C41 107.7(4) . . ?
C40 P31 C45 104.7(3) . . ?
C41 P31 C45 114.9(4) . . ?
C40 P31 Pt30 103.9(2) . . ?
C41 P31 Pt30 110.3(3) . . ?
C45 P31 Pt30 114.4(2) . . ?
C33 P32 C53 106.8(4) . . ?
C33 P32 C49 103.5(4) . . ?
C53 P32 C49 116.7(4) . . ?
C33 P32 Pt30 103.5(3) . . ?
C53 P32 Pt30 113.1(3) . . ?
C49 P32 Pt30 111.8(3) . . ?
C34 C33 P32 111.1(6) . . ?
C34 C33 H33A 109.4 . . ?
P32 C33 H33A 109.4 . . ?
C34 C33 H33B 109.4 . . ?
P32 C33 H33B 109.4 . . ?
H33A C33 H33B 108.0 . . ?
C35 C34 C39 121.3(6) . . ?
C35 C34 C33 118.0(7) . . ?
C39 C34 C33 120.7(7) . . ?
C34 C35 C36 119.8(8) . . ?
C34 C35 H35 120.1 . . ?
C36 C35 H35 120.1 . . ?
C37 C36 C35 119.8(7) . . ?
C37 C36 H36 120.1 . . ?
C35 C36 H36 120.1 . . ?
C38 C37 C36 120.7(7) . . ?
C38 C37 H37 119.7 . . ?
C36 C37 H37 119.7 . . ?
C37 C38 C39 120.1(7) . . ?
C37 C38 C40 118.9(6) . . ?
C39 C38 C40 121.0(7) . . ?
C34 C39 C38 118.4(7) . . ?
C34 C39 Pt30 121.0(5) . . ?
C38 C39 Pt30 120.5(6) . . ?
C38 C40 P31 110.0(5) . . ?
C38 C40 H40A 109.7 . . ?
P31 C40 H40A 109.7 . . ?
C38 C40 H40B 109.7 . . ?
P31 C40 H40B 109.7 . . ?
H40A C40 H40B 108.2 . . ?
C44 C41 C43 109.0(7) . . ?
C44 C41 C42 107.9(7) . . ?
C43 C41 C42 109.0(6) . . ?
C44 C41 P31 111.6(5) . . ?
C43 C41 P31 113.4(5) . . ?
C42 C41 P31 105.9(5) . . ?
C41 C42 H42A 109.5 . . ?
C41 C42 H42B 109.5 . . ?
H42A C42 H42B 109.5 . . ?
C41 C42 H42C 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
C41 C43 H43A 109.5 . . ?
C41 C43 H43B 109.5 . . ?
H43A C43 H43B 109.5 . . ?
C41 C43 H43C 109.5 . . ?
H43A C43 H43C 109.5 . . ?
H43B C43 H43C 109.5 . . ?
C41 C44 H44A 109.5 . . ?
C41 C44 H44B 109.5 . . ?
H44A C44 H44B 109.5 . . ?
C41 C44 H44C 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
C46 C45 C47 108.8(7) . . ?
C46 C45 C48 109.6(7) . . ?
C47 C45 C48 108.9(6) . . ?
C46 C45 P31 111.6(5) . . ?
C47 C45 P31 106.0(6) . . ?
C48 C45 P31 111.7(5) . . ?
C45 C46 H46A 109.5 . . ?
C45 C46 H46B 109.5 . . ?
H46A C46 H46B 109.5 . . ?
C45 C46 H46C 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
C45 C47 H47A 109.5 . . ?
C45 C47 H47B 109.5 . . ?
H47A C47 H47B 109.5 . . ?
C45 C47 H47C 109.5 . . ?
H47A C47 H47C 109.5 . . ?
H47B C47 H47C 109.5 . . ?
C45 C48 H48A 109.5 . . ?
C45 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
C45 C48 H48C 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
C51B C49 C50 113.6(14) . . ?
C51B C49 C52A 85(2) . . ?
C50 C49 C52A 116.8(10) . . ?
C51B C49 C52B 114(2) . . ?
C50 C49 C52B 98.6(14) . . ?
C52A C49 C52B 29.6(10) . . ?
C51B C49 C51A 20.7(13) . . ?
C50 C49 C51A 102.2(10) . . ?
C52A C49 C51A 106(2) . . ?
C52B C49 C51A 135(2) . . ?
C51B C49 P32 114.6(13) . . ?
C50 C49 P32 114.0(6) . . ?
C52A C49 P32 109.7(8) . . ?
C52B C49 P32 100.0(10) . . ?
C51A C49 P32 107.4(9) . . ?
C49 C50 H50A 109.5 . . ?
C49 C50 H50B 109.5 . . ?
H50A C50 H50B 109.5 . . ?
C49 C50 H50C 109.5 . . ?
H50A C50 H50C 109.5 . . ?
H50B C50 H50C 109.5 . . ?
C49 C51A H51A 109.5 . . ?
C49 C51A H51B 109.5 . . ?
C49 C51A H51C 109.5 . . ?
C49 C52A H52A 109.5 . . ?
C49 C52A H52B 109.5 . . ?
C49 C52A H52C 109.5 . . ?
C49 C51B H51D 109.5 . . ?
C49 C51B H51E 109.5 . . ?
H51D C51B H51E 109.5 . . ?
C49 C51B H51F 109.5 . . ?
H51D C51B H51F 109.5 . . ?
H51E C51B H51F 109.5 . . ?
C49 C52B H52D 109.5 . . ?
C49 C52B H52E 109.5 . . ?
H52D C52B H52E 109.5 . . ?
C49 C52B H52F 109.5 . . ?
H52D C52B H52F 109.5 . . ?
H52E C52B H52F 109.5 . . ?
C56 C53 C55 109.5(8) . . ?
C56 C53 C54 109.5(7) . . ?
C55 C53 C54 108.7(7) . . ?
C56 C53 P32 111.6(5) . . ?
C55 C53 P32 104.7(5) . . ?
C54 C53 P32 112.6(6) . . ?
C53 C54 H54A 109.5 . . ?
C53 C54 H54B 109.5 . . ?
H54A C54 H54B 109.5 . . ?
C53 C54 H54C 109.5 . . ?
H54A C54 H54C 109.5 . . ?
H54B C54 H54C 109.5 . . ?
C53 C55 H55A 109.5 . . ?
C53 C55 H55B 109.5 . . ?
H55A C55 H55B 109.5 . . ?
C53 C55 H55C 109.5 . . ?
H55A C55 H55C 109.5 . . ?
H55B C55 H55C 109.5 . . ?
C53 C56 H56A 109.5 . . ?
C53 C56 H56B 109.5 . . ?
H56A C56 H56B 109.5 . . ?
C53 C56 H56C 109.5 . . ?
H56A C56 H56C 109.5 . . ?
H56B C56 H56C 109.5 . . ?
O58 C57 Pt30 176.8(8) . . ?
C86 Pt59 C68 179.1(3) . . ?
C86 Pt59 P60 96.7(2) . . ?
C68 Pt59 P60 83.7(2) . . ?
C86 Pt59 P61 96.7(2) . . ?
C68 Pt59 P61 82.9(2) . . ?
P60 Pt59 P61 166.07(7) . . ?
C69 P60 C70 104.3(4) . . ?
C69 P60 C74 106.2(3) . . ?
C70 P60 C74 114.3(3) . . ?
C69 P60 Pt59 103.4(2) . . ?
C70 P60 Pt59 115.5(2) . . ?
C74 P60 Pt59 111.9(3) . . ?
C62 P61 C78 105.8(4) . . ?
C62 P61 C82 105.1(4) . . ?
C78 P61 C82 116.0(4) . . ?
C62 P61 Pt59 102.8(2) . . ?
C78 P61 Pt59 111.0(2) . . ?
C82 P61 Pt59 114.6(2) . . ?
C63 C62 P61 109.8(5) . . ?
C63 C62 H62A 109.7 . . ?
P61 C62 H62A 109.7 . . ?
C63 C62 H62B 109.7 . . ?
P61 C62 H62B 109.7 . . ?
H62A C62 H62B 108.2 . . ?
C64 C63 C68 118.8(7) . . ?
C64 C63 C62 120.2(6) . . ?
C68 C63 C62 120.7(6) . . ?
C65 C64 C63 122.2(7) . . ?
C65 C64 H64 118.9 . . ?
C63 C64 H64 118.9 . . ?
C64 C65 C66 119.8(7) . . ?
C64 C65 H65 120.1 . . ?
C66 C65 H65 120.1 . . ?
C65 C66 C67 119.5(7) . . ?
C65 C66 H66 120.2 . . ?
C67 C66 H66 120.2 . . ?
C68 C67 C66 121.0(6) . . ?
C68 C67 C69 121.2(6) . . ?
C66 C67 C69 117.6(7) . . ?
C67 C68 C63 118.6(6) . . ?
C67 C68 Pt59 120.6(5) . . ?
C63 C68 Pt59 120.7(6) . . ?
C67 C69 P60 109.5(5) . . ?
C67 C69 H69A 109.8 . . ?
P60 C69 H69A 109.8 . . ?
C67 C69 H69B 109.8 . . ?
P60 C69 H69B 109.8 . . ?
H69A C69 H69B 108.2 . . ?
C73 C70 C71 109.7(6) . . ?
C73 C70 C72 108.4(7) . . ?
C71 C70 C72 109.5(7) . . ?
C73 C70 P60 111.7(6) . . ?
C71 C70 P60 111.9(5) . . ?
C72 C70 P60 105.5(5) . . ?
C70 C71 H71A 109.5 . . ?
C70 C71 H71B 109.5 . . ?
H71A C71 H71B 109.5 . . ?
C70 C71 H71C 109.5 . . ?
H71A C71 H71C 109.5 . . ?
H71B C71 H71C 109.5 . . ?
C70 C72 H72A 109.5 . . ?
C70 C72 H72B 109.5 . . ?
H72A C72 H72B 109.5 . . ?
C70 C72 H72C 109.5 . . ?
H72A C72 H72C 109.5 . . ?
H72B C72 H72C 109.5 . . ?
C70 C73 H73A 109.5 . . ?
C70 C73 H73B 109.5 . . ?
H73A C73 H73B 109.5 . . ?
C70 C73 H73C 109.5 . . ?
H73A C73 H73C 109.5 . . ?
H73B C73 H73C 109.5 . . ?
C77 C74 C76 110.4(6) . . ?
C77 C74 C75 108.5(7) . . ?
C76 C74 C75 109.7(6) . . ?
C77 C74 P60 110.4(5) . . ?
C76 C74 P60 112.6(5) . . ?
C75 C74 P60 105.0(5) . . ?
C74 C75 H75A 109.5 . . ?
C74 C75 H75B 109.5 . . ?
H75A C75 H75B 109.5 . . ?
C74 C75 H75C 109.5 . . ?
H75A C75 H75C 109.5 . . ?
H75B C75 H75C 109.5 . . ?
C74 C76 H76A 109.5 . . ?
C74 C76 H76B 109.5 . . ?
H76A C76 H76B 109.5 . . ?
C74 C76 H76C 109.5 . . ?
H76A C76 H76C 109.5 . . ?
H76B C76 H76C 109.5 . . ?
C74 C77 H77A 109.5 . . ?
C74 C77 H77B 109.5 . . ?
H77A C77 H77B 109.5 . . ?
C74 C77 H77C 109.5 . . ?
H77A C77 H77C 109.5 . . ?
H77B C77 H77C 109.5 . . ?
C79 C78 C81 109.8(7) . . ?
C79 C78 C80 108.3(6) . . ?
C81 C78 C80 108.5(6) . . ?
C79 C78 P61 110.7(5) . . ?
C81 C78 P61 112.5(5) . . ?
C80 C78 P61 106.9(6) . . ?
C78 C79 H79A 109.5 . . ?
C78 C79 H79B 109.5 . . ?
H79A C79 H79B 109.5 . . ?
C78 C79 H79C 109.5 . . ?
H79A C79 H79C 109.5 . . ?
H79B C79 H79C 109.5 . . ?
C78 C80 H80A 109.5 . . ?
C78 C80 H80B 109.5 . . ?
H80A C80 H80B 109.5 . . ?
C78 C80 H80C 109.5 . . ?
H80A C80 H80C 109.5 . . ?
H80B C80 H80C 109.5 . . ?
C78 C81 H81A 109.5 . . ?
C78 C81 H81B 109.5 . . ?
H81A C81 H81B 109.5 . . ?
C78 C81 H81C 109.5 . . ?
H81A C81 H81C 109.5 . . ?
H81B C81 H81C 109.5 . . ?
C83 C82 C84 109.8(7) . . ?
C83 C82 C85 108.3(7) . . ?
C84 C82 C85 107.8(7) . . ?
C83 C82 P61 106.0(6) . . ?
C84 C82 P61 113.1(5) . . ?
C85 C82 P61 111.8(5) . . ?
C82 C83 H83A 109.5 . . ?
C82 C83 H83B 109.5 . . ?
H83A C83 H83B 109.5 . . ?
C82 C83 H83C 109.5 . . ?
H83A C83 H83C 109.5 . . ?
H83B C83 H83C 109.5 . . ?
C82 C84 H84A 109.5 . . ?
C82 C84 H84B 109.5 . . ?
H84A C84 H84B 109.5 . . ?
C82 C84 H84C 109.5 . . ?
H84A C84 H84C 109.5 . . ?
H84B C84 H84C 109.5 . . ?
C82 C85 H85A 109.5 . . ?
C82 C85 H85B 109.5 . . ?
H85A C85 H85B 109.5 . . ?
C82 C85 H85C 109.5 . . ?
H85A C85 H85C 109.5 . . ?
H85B C85 H85C 109.5 . . ?
O87 C86 Pt59 179.3(8) . . ?
F92 B88 F89 108.4(8) . . ?
F92 B88 F90 107.9(7) . . ?
F89 B88 F90 111.4(8) . . ?
F92 B88 F91 110.3(9) . . ?
F89 B88 F91 108.9(7) . . ?
F90 B88 F91 110.0(8) . . ?
F97 B93 F95 110.7(7) . . ?
F97 B93 F96 111.1(8) . . ?
F95 B93 F96 110.6(8) . . ?
F97 B93 F94 108.1(8) . . ?
F95 B93 F94 106.9(7) . . ?
F96 B93 F94 109.3(7) . . ?
F102 B98 F101 112.3(9) . . ?
F102 B98 F100 112.4(7) . . ?
F101 B98 F100 108.9(8) . . ?
F102 B98 F99 109.6(8) . . ?
F101 B98 F99 105.4(7) . . ?
F100 B98 F99 108.0(9) . . ?
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 C28 1.926(8) . ?
Pt1 C10 2.053(7) . ?
Pt1 P2 2.3211(18) . ?
Pt1 P3 2.3235(17) . ?
P2 C11 1.819(7) . ?
P2 C12 1.856(7) . ?
P2 C16 1.875(7) . ?
P3 C4 1.833(7) . ?
P3 C24 1.851(8) . ?
P3 C20 1.865(7) . ?
C4 C5 1.498(10) . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C5 C10 1.405(9) . ?
C5 C6 1.407(10) . ?
C6 C7 1.373(10) . ?
C6 H6 0.9500 . ?
C7 C8 1.400(9) . ?
C7 H7 0.9500 . ?
C8 C9 1.391(10) . ?
C8 H8 0.9500 . ?
C9 C10 1.415(10) . ?
C9 C11 1.520(9) . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C12 C15 1.535(10) . ?
C12 C14 1.542(10) . ?
C12 C13 1.551(9) . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
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 C19 1.521(10) . ?
C16 C17 1.538(10) . ?
C16 C18 1.559(10) . ?
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 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 C21 1.527(11) . ?
C20 C22 1.536(9) . ?
C20 C23 1.536(11) . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 C25 1.536(11) . ?
C24 C26 1.540(10) . ?
C24 C27 1.544(10) . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
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 O29 1.116(9) . ?
Pt30 C57 1.940(8) . ?
Pt30 C39 2.061(7) . ?
Pt30 P32 2.3153(18) . ?
Pt30 P31 2.3239(17) . ?
P31 C40 1.828(7) . ?
P31 C41 1.864(7) . ?
P31 C45 1.872(8) . ?
P32 C33 1.820(9) . ?
P32 C53 1.855(7) . ?
P32 C49 1.869(8) . ?
C33 C34 1.513(9) . ?
C33 H33A 0.9900 . ?
C33 H33B 0.9900 . ?
C34 C35 1.386(10) . ?
C34 C39 1.393(10) . ?
C35 C36 1.396(9) . ?
C35 H35 0.9500 . ?
C36 C37 1.390(11) . ?
C36 H36 0.9500 . ?
C37 C38 1.383(10) . ?
C37 H37 0.9500 . ?
C38 C39 1.420(9) . ?
C38 C40 1.503(10) . ?
C40 H40A 0.9900 . ?
C40 H40B 0.9900 . ?
C41 C44 1.525(10) . ?
C41 C43 1.525(10) . ?
C41 C42 1.560(11) . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C43 H43A 0.9800 . ?
C43 H43B 0.9800 . ?
C43 H43C 0.9800 . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
C45 C46 1.516(11) . ?
C45 C47 1.534(10) . ?
C45 C48 1.544(9) . ?
C46 H46A 0.9800 . ?
C46 H46B 0.9800 . ?
C46 H46C 0.9800 . ?
C47 H47A 0.9800 . ?
C47 H47B 0.9800 . ?
C47 H47C 0.9800 . ?
C48 H48A 0.9800 . ?
C48 H48B 0.9800 . ?
C48 H48C 0.9800 . ?
C49 C51B 1.39(3) . ?
C49 C50 1.509(11) . ?
C49 C52A 1.528(16) . ?
C49 C52B 1.62(3) . ?
C49 C51A 1.69(3) . ?
C50 H50A 0.9800 . ?
C50 H50B 0.9800 . ?
C50 H50C 0.9800 . ?
C51A H51A 0.9800 . ?
C51A H51B 0.9800 . ?
C51A H51C 0.9800 . ?
C52A H52A 0.9800 . ?
C52A H52B 0.9800 . ?
C52A H52C 0.9800 . ?
C51B H51D 0.9800 . ?
C51B H51E 0.9800 . ?
C51B H51F 0.9800 . ?
C52B H52D 0.9800 . ?
C52B H52E 0.9800 . ?
C52B H52F 0.9800 . ?
C53 C56 1.516(12) . ?
C53 C55 1.541(10) . ?
C53 C54 1.546(10) . ?
C54 H54A 0.9800 . ?
C54 H54B 0.9800 . ?
C54 H54C 0.9800 . ?
C55 H55A 0.9800 . ?
C55 H55B 0.9800 . ?
C55 H55C 0.9800 . ?
C56 H56A 0.9800 . ?
C56 H56B 0.9800 . ?
C56 H56C 0.9800 . ?
C57 O58 1.105(9) . ?
Pt59 C86 1.934(8) . ?
Pt59 C68 2.054(7) . ?
Pt59 P60 2.3189(19) . ?
Pt59 P61 2.3312(18) . ?
P60 C69 1.841(8) . ?
P60 C70 1.874(7) . ?
P60 C74 1.875(7) . ?
P61 C62 1.835(7) . ?
P61 C78 1.855(9) . ?
P61 C82 1.867(7) . ?
C62 C63 1.482(10) . ?
C62 H62A 0.9900 . ?
C62 H62B 0.9900 . ?
C63 C64 1.395(10) . ?
C63 C68 1.416(9) . ?
C64 C65 1.377(10) . ?
C64 H64 0.9500 . ?
C65 C66 1.383(9) . ?
C65 H65 0.9500 . ?
C66 C67 1.407(10) . ?
C66 H66 0.9500 . ?
C67 C68 1.405(10) . ?
C67 C69 1.511(9) . ?
C69 H69A 0.9900 . ?
C69 H69B 0.9900 . ?
C70 C73 1.524(11) . ?
C70 C71 1.534(11) . ?
C70 C72 1.543(10) . ?
C71 H71A 0.9800 . ?
C71 H71B 0.9800 . ?
C71 H71C 0.9800 . ?
C72 H72A 0.9800 . ?
C72 H72B 0.9800 . ?
C72 H72C 0.9800 . ?
C73 H73A 0.9800 . ?
C73 H73B 0.9800 . ?
C73 H73C 0.9800 . ?
C74 C77 1.513(10) . ?
C74 C76 1.530(10) . ?
C74 C75 1.543(10) . ?
C75 H75A 0.9800 . ?
C75 H75B 0.9800 . ?
C75 H75C 0.9800 . ?
C76 H76A 0.9800 . ?
C76 H76B 0.9800 . ?
C76 H76C 0.9800 . ?
C77 H77A 0.9800 . ?
C77 H77B 0.9800 . ?
C77 H77C 0.9800 . ?
C78 C79 1.519(10) . ?
C78 C81 1.532(10) . ?
C78 C80 1.543(10) . ?
C79 H79A 0.9800 . ?
C79 H79B 0.9800 . ?
C79 H79C 0.9800 . ?
C80 H80A 0.9800 . ?
C80 H80B 0.9800 . ?
C80 H80C 0.9800 . ?
C81 H81A 0.9800 . ?
C81 H81B 0.9800 . ?
C81 H81C 0.9800 . ?
C82 C83 1.509(12) . ?
C82 C84 1.526(10) . ?
C82 C85 1.546(11) . ?
C83 H83A 0.9800 . ?
C83 H83B 0.9800 . ?
C83 H83C 0.9800 . ?
C84 H84A 0.9800 . ?
C84 H84B 0.9800 . ?
C84 H84C 0.9800 . ?
C85 H85A 0.9800 . ?
C85 H85B 0.9800 . ?
C85 H85C 0.9800 . ?
C86 O87 1.111(9) . ?
B88 F92 1.370(10) . ?
B88 F89 1.372(10) . ?
B88 F90 1.373(11) . ?
B88 F91 1.385(10) . ?
B93 F97 1.335(10) . ?
B93 F95 1.366(10) . ?
B93 F96 1.372(10) . ?
B93 F94 1.423(10) . ?
B98 F102 1.336(11) . ?
B98 F101 1.353(10) . ?
B98 F100 1.373(11) . ?
B98 F99 1.398(11) . ?
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C28 Pt1 P2 C11 173.2(4) . . . . ?
C10 Pt1 P2 C11 -14.1(3) . . . . ?
P3 Pt1 P2 C11 -4.9(4) . . . . ?
C28 Pt1 P2 C12 -72.5(3) . . . . ?
C10 Pt1 P2 C12 100.2(3) . . . . ?
P3 Pt1 P2 C12 109.3(4) . . . . ?
C28 Pt1 P2 C16 60.8(3) . . . . ?
C10 Pt1 P2 C16 -126.5(3) . . . . ?
P3 Pt1 P2 C16 -117.4(3) . . . . ?
C28 Pt1 P3 C4 158.1(3) . . . . ?
C10 Pt1 P3 C4 -14.6(3) . . . . ?
P2 Pt1 P3 C4 -23.7(4) . . . . ?
C28 Pt1 P3 C24 -87.4(4) . . . . ?
C10 Pt1 P3 C24 99.9(3) . . . . ?
P2 Pt1 P3 C24 90.8(4) . . . . ?
C28 Pt1 P3 C20 44.9(4) . . . . ?
C10 Pt1 P3 C20 -127.8(4) . . . . ?
P2 Pt1 P3 C20 -136.9(4) . . . . ?
C24 P3 C4 C5 -98.8(6) . . . . ?
C20 P3 C4 C5 137.9(5) . . . . ?
Pt1 P3 C4 C5 17.5(6) . . . . ?
P3 C4 C5 C10 -11.7(9) . . . . ?
P3 C4 C5 C6 172.4(6) . . . . ?
C10 C5 C6 C7 0.8(11) . . . . ?
C4 C5 C6 C7 176.8(7) . . . . ?
C5 C6 C7 C8 0.0(11) . . . . ?
C6 C7 C8 C9 0.9(11) . . . . ?
C7 C8 C9 C10 -2.6(11) . . . . ?
C7 C8 C9 C11 175.6(6) . . . . ?
C6 C5 C10 C9 -2.5(11) . . . . ?
C4 C5 C10 C9 -178.3(7) . . . . ?
C6 C5 C10 Pt1 173.6(5) . . . . ?
C4 C5 C10 Pt1 -2.3(10) . . . . ?
C8 C9 C10 C5 3.4(11) . . . . ?
C11 C9 C10 C5 -174.9(6) . . . . ?
C8 C9 C10 Pt1 -172.6(5) . . . . ?
C11 C9 C10 Pt1 9.1(9) . . . . ?
P2 Pt1 C10 C5 -170.9(6) . . . . ?
P3 Pt1 C10 C5 11.4(6) . . . . ?
P2 Pt1 C10 C9 5.0(6) . . . . ?
P3 Pt1 C10 C9 -172.7(6) . . . . ?
C8 C9 C11 P2 160.3(6) . . . . ?
C10 C9 C11 P2 -21.4(9) . . . . ?
C12 P2 C11 C9 -96.6(6) . . . . ?
C16 P2 C11 C9 141.1(5) . . . . ?
Pt1 P2 C11 C9 21.8(6) . . . . ?
C11 P2 C12 C15 -67.5(6) . . . . ?
C16 P2 C12 C15 47.7(7) . . . . ?
Pt1 P2 C12 C15 -179.6(5) . . . . ?
C11 P2 C12 C14 169.3(5) . . . . ?
C16 P2 C12 C14 -75.5(6) . . . . ?
Pt1 P2 C12 C14 57.2(5) . . . . ?
C11 P2 C12 C13 53.0(6) . . . . ?
C16 P2 C12 C13 168.3(5) . . . . ?
Pt1 P2 C12 C13 -59.0(5) . . . . ?
C11 P2 C16 C19 173.2(5) . . . . ?
C12 P2 C16 C19 56.8(6) . . . . ?
Pt1 P2 C16 C19 -75.2(5) . . . . ?
C11 P2 C16 C17 -68.3(6) . . . . ?
C12 P2 C16 C17 175.2(5) . . . . ?
Pt1 P2 C16 C17 43.3(6) . . . . ?
C11 P2 C16 C18 50.7(6) . . . . ?
C12 P2 C16 C18 -65.8(6) . . . . ?
Pt1 P2 C16 C18 162.3(4) . . . . ?
C4 P3 C20 C21 167.9(5) . . . . ?
C24 P3 C20 C21 49.5(6) . . . . ?
Pt1 P3 C20 C21 -80.3(6) . . . . ?
C4 P3 C20 C22 44.8(7) . . . . ?
C24 P3 C20 C22 -73.6(7) . . . . ?
Pt1 P3 C20 C22 156.6(5) . . . . ?
C4 P3 C20 C23 -73.2(6) . . . . ?
C24 P3 C20 C23 168.4(5) . . . . ?
Pt1 P3 C20 C23 38.6(6) . . . . ?
C4 P3 C24 C25 169.6(5) . . . . ?
C20 P3 C24 C25 -73.6(6) . . . . ?
Pt1 P3 C24 C25 58.5(6) . . . . ?
C4 P3 C24 C26 50.5(6) . . . . ?
C20 P3 C24 C26 167.2(5) . . . . ?
Pt1 P3 C24 C26 -60.7(5) . . . . ?
C4 P3 C24 C27 -68.4(6) . . . . ?
C20 P3 C24 C27 48.4(7) . . . . ?
Pt1 P3 C24 C27 -179.5(5) . . . . ?
C57 Pt30 P31 C40 176.7(4) . . . . ?
C39 Pt30 P31 C40 -6.3(3) . . . . ?
P32 Pt30 P31 C40 -17.2(4) . . . . ?
C57 Pt30 P31 C41 -68.2(4) . . . . ?
C39 Pt30 P31 C41 108.8(3) . . . . ?
P32 Pt30 P31 C41 97.9(4) . . . . ?
C57 Pt30 P31 C45 63.2(4) . . . . ?
C39 Pt30 P31 C45 -119.8(3) . . . . ?
P32 Pt30 P31 C45 -130.7(4) . . . . ?
C57 Pt30 P32 C33 175.5(4) . . . . ?
C39 Pt30 P32 C33 -1.5(4) . . . . ?
P31 Pt30 P32 C33 9.4(5) . . . . ?
C57 Pt30 P32 C53 -69.3(4) . . . . ?
C39 Pt30 P32 C53 113.7(3) . . . . ?
P31 Pt30 P32 C53 124.6(4) . . . . ?
C57 Pt30 P32 C49 64.8(4) . . . . ?
C39 Pt30 P32 C49 -112.2(4) . . . . ?
P31 Pt30 P32 C49 -101.3(4) . . . . ?
C53 P32 C33 C34 -117.7(7) . . . . ?
C49 P32 C33 C34 118.6(6) . . . . ?
Pt30 P32 C33 C34 1.8(7) . . . . ?
P32 C33 C34 C35 -179.4(6) . . . . ?
P32 C33 C34 C39 -1.3(11) . . . . ?
C39 C34 C35 C36 -1.8(11) . . . . ?
C33 C34 C35 C36 176.3(7) . . . . ?
C34 C35 C36 C37 1.1(11) . . . . ?
C35 C36 C37 C38 0.5(11) . . . . ?
C36 C37 C38 C39 -1.6(11) . . . . ?
C36 C37 C38 C40 175.0(7) . . . . ?
C35 C34 C39 C38 0.7(11) . . . . ?
C33 C34 C39 C38 -177.3(7) . . . . ?
C35 C34 C39 Pt30 177.9(5) . . . . ?
C33 C34 C39 Pt30 -0.1(10) . . . . ?
C37 C38 C39 C34 0.9(11) . . . . ?
C40 C38 C39 C34 -175.6(7) . . . . ?
C37 C38 C39 Pt30 -176.2(6) . . . . ?
C40 C38 C39 Pt30 7.3(9) . . . . ?
P32 Pt30 C39 C34 1.1(6) . . . . ?
P31 Pt30 C39 C34 -176.4(6) . . . . ?
P32 Pt30 C39 C38 178.2(6) . . . . ?
P31 Pt30 C39 C38 0.7(5) . . . . ?
C37 C38 C40 P31 170.9(6) . . . . ?
C39 C38 C40 P31 -12.5(9) . . . . ?
C41 P31 C40 C38 -105.9(6) . . . . ?
C45 P31 C40 C38 131.4(5) . . . . ?
Pt30 P31 C40 C38 11.1(6) . . . . ?
C40 P31 C41 C44 164.1(6) . . . . ?
C45 P31 C41 C44 -79.6(6) . . . . ?
Pt30 P31 C41 C44 51.4(6) . . . . ?
C40 P31 C41 C43 -72.4(7) . . . . ?
C45 P31 C41 C43 43.9(7) . . . . ?
Pt30 P31 C41 C43 174.9(5) . . . . ?
C40 P31 C41 C42 47.0(6) . . . . ?
C45 P31 C41 C42 163.3(5) . . . . ?
Pt30 P31 C41 C42 -65.7(5) . . . . ?
C40 P31 C45 C46 172.9(5) . . . . ?
C41 P31 C45 C46 55.0(6) . . . . ?
Pt30 P31 C45 C46 -74.1(5) . . . . ?
C40 P31 C45 C47 -68.8(5) . . . . ?
C41 P31 C45 C47 173.3(5) . . . . ?
Pt30 P31 C45 C47 44.2(6) . . . . ?
C40 P31 C45 C48 49.7(6) . . . . ?
C41 P31 C45 C48 -68.2(6) . . . . ?
Pt30 P31 C45 C48 162.8(4) . . . . ?
C33 P32 C49 C51B -170.8(16) . . . . ?
C53 P32 C49 C51B 72.2(16) . . . . ?
Pt30 P32 C49 C51B -60.1(16) . . . . ?
C33 P32 C49 C50 56.0(7) . . . . ?
C53 P32 C49 C50 -61.0(8) . . . . ?
Pt30 P32 C49 C50 166.7(6) . . . . ?
C33 P32 C49 C52A -77.2(14) . . . . ?
C53 P32 C49 C52A 165.8(13) . . . . ?
Pt30 P32 C49 C52A 33.5(14) . . . . ?
C33 P32 C49 C52B -48.3(15) . . . . ?
C53 P32 C49 C52B -165.2(15) . . . . ?
Pt30 P32 C49 C52B 62.5(15) . . . . ?
C33 P32 C49 C51A 168.4(11) . . . . ?
C53 P32 C49 C51A 51.4(12) . . . . ?
Pt30 P32 C49 C51A -80.9(11) . . . . ?
C33 P32 C53 C56 177.5(6) . . . . ?
C49 P32 C53 C56 -67.3(7) . . . . ?
Pt30 P32 C53 C56 64.4(6) . . . . ?
C33 P32 C53 C55 59.1(7) . . . . ?
C49 P32 C53 C55 174.3(6) . . . . ?
Pt30 P32 C53 C55 -54.0(7) . . . . ?
C33 P32 C53 C54 -58.8(6) . . . . ?
C49 P32 C53 C54 56.3(7) . . . . ?
Pt30 P32 C53 C54 -172.0(5) . . . . ?
C86 Pt59 P60 C69 173.2(4) . . . . ?
C68 Pt59 P60 C69 -6.0(3) . . . . ?
P61 Pt59 P60 C69 -22.7(4) . . . . ?
C86 Pt59 P60 C70 60.0(4) . . . . ?
C68 Pt59 P60 C70 -119.2(3) . . . . ?
P61 Pt59 P60 C70 -135.9(4) . . . . ?
C86 Pt59 P60 C74 -73.0(3) . . . . ?
C68 Pt59 P60 C74 107.9(3) . . . . ?
P61 Pt59 P60 C74 91.1(4) . . . . ?
C86 Pt59 P61 C62 -169.4(4) . . . . ?
C68 Pt59 P61 C62 9.7(3) . . . . ?
P60 Pt59 P61 C62 26.5(4) . . . . ?
C86 Pt59 P61 C78 77.9(4) . . . . ?
C68 Pt59 P61 C78 -103.0(3) . . . . ?
P60 Pt59 P61 C78 -86.2(4) . . . . ?
C86 Pt59 P61 C82 -55.9(4) . . . . ?
C68 Pt59 P61 C82 123.2(4) . . . . ?
P60 Pt59 P61 C82 140.0(4) . . . . ?
C78 P61 C62 C63 99.5(6) . . . . ?
C82 P61 C62 C63 -137.3(6) . . . . ?
Pt59 P61 C62 C63 -17.0(6) . . . . ?
P61 C62 C63 C64 -166.6(6) . . . . ?
P61 C62 C63 C68 18.9(10) . . . . ?
C68 C63 C64 C65 0.2(12) . . . . ?
C62 C63 C64 C65 -174.4(8) . . . . ?
C63 C64 C65 C66 2.1(12) . . . . ?
C64 C65 C66 C67 -2.6(11) . . . . ?
C65 C66 C67 C68 0.8(11) . . . . ?
C65 C66 C67 C69 175.7(7) . . . . ?
C66 C67 C68 C63 1.5(11) . . . . ?
C69 C67 C68 C63 -173.3(7) . . . . ?
C66 C67 C68 Pt59 -175.3(5) . . . . ?
C69 C67 C68 Pt59 9.9(10) . . . . ?
C64 C63 C68 C67 -2.0(11) . . . . ?
C62 C63 C68 C67 172.6(7) . . . . ?
C64 C63 C68 Pt59 174.8(6) . . . . ?
C62 C63 C68 Pt59 -10.6(10) . . . . ?
P60 Pt59 C68 C67 -0.8(5) . . . . ?
P61 Pt59 C68 C67 175.2(6) . . . . ?
P60 Pt59 C68 C63 -177.6(6) . . . . ?
P61 Pt59 C68 C63 -1.6(5) . . . . ?
C68 C67 C69 P60 -14.5(9) . . . . ?
C66 C67 C69 P60 170.5(5) . . . . ?
C70 P60 C69 C67 132.8(5) . . . . ?
C74 P60 C69 C67 -106.2(5) . . . . ?
Pt59 P60 C69 C67 11.7(6) . . . . ?
C69 P60 C70 C73 174.1(5) . . . . ?
C74 P60 C70 C73 58.7(6) . . . . ?
Pt59 P60 C70 C73 -73.2(5) . . . . ?
C69 P60 C70 C71 50.7(6) . . . . ?
C74 P60 C70 C71 -64.8(6) . . . . ?
Pt59 P60 C70 C71 163.4(5) . . . . ?
C69 P60 C70 C72 -68.3(7) . . . . ?
C74 P60 C70 C72 176.3(6) . . . . ?
Pt59 P60 C70 C72 44.4(7) . . . . ?
C69 P60 C74 C77 167.3(5) . . . . ?
C70 P60 C74 C77 -78.4(6) . . . . ?
Pt59 P60 C74 C77 55.2(6) . . . . ?
C69 P60 C74 C76 -68.8(6) . . . . ?
C70 P60 C74 C76 45.5(6) . . . . ?
Pt59 P60 C74 C76 179.1(4) . . . . ?
C69 P60 C74 C75 50.5(6) . . . . ?
C70 P60 C74 C75 164.9(5) . . . . ?
Pt59 P60 C74 C75 -61.5(5) . . . . ?
C62 P61 C78 C79 -168.1(5) . . . . ?
C82 P61 C78 C79 75.9(6) . . . . ?
Pt59 P61 C78 C79 -57.3(6) . . . . ?
C62 P61 C78 C81 68.6(6) . . . . ?
C82 P61 C78 C81 -47.5(7) . . . . ?
Pt59 P61 C78 C81 179.4(5) . . . . ?
C62 P61 C78 C80 -50.3(6) . . . . ?
C82 P61 C78 C80 -166.4(5) . . . . ?
Pt59 P61 C78 C80 60.5(5) . . . . ?
C62 P61 C82 C83 72.2(7) . . . . ?
C78 P61 C82 C83 -171.4(6) . . . . ?
Pt59 P61 C82 C83 -39.9(7) . . . . ?
C62 P61 C82 C84 -48.1(7) . . . . ?
C78 P61 C82 C84 68.3(7) . . . . ?
Pt59 P61 C82 C84 -160.2(5) . . . . ?
C62 P61 C82 C85 -170.0(6) . . . . ?
C78 P61 C82 C85 -53.5(7) . . . . ?
Pt59 P61 C82 C85 77.9(6) . . . . ?
