#------------------------------------------------------------------------------
#$Date: 2016-03-25 11:08:49 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179777 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/73/7007387.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_7007387
loop_
_publ_author_name
'de Quadras, Laura'
'Hampel, Frank'
'Gladysz, J. A.'
_publ_section_title
;
 Wire-like PtC[triple bond]CC[triple bond]CC[triple bond]CC[triple
 bond]CPt moieties surrounded by double-helical "insulation": new
 motifs featuring P(CH2)20P and P(CH2)4O(CH2)2O(CH2)4P linkages.
;
_journal_issue                   24
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2929
_journal_page_last               2933
_journal_paper_doi               10.1039/b604465b
_journal_year                    2006
_chemical_formula_sum            'C108 H120 F10 P4 Pt2'
_chemical_formula_weight         2122.10
_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                 102.57(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   39.9137(6)
_cell_length_b                   11.1431(2)
_cell_length_c                   22.6389(4)
_cell_measurement_reflns_used    18965
_cell_measurement_temperature    173(2)
_cell_volume                     9827.6(12)
_computing_cell_refinement       DENZO-SMN
_computing_data_collection       'Nonius Collect'
_computing_data_reduction        DENZO-SMN
_computing_molecular_graphics    'SHELXTL NT'
_computing_publication_material  'SHELXTL NT'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.945
_diffrn_measured_fraction_theta_max 0.945
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0490
_diffrn_reflns_av_sigmaI/netI    0.0794
_diffrn_reflns_limit_h_max       51
_diffrn_reflns_limit_h_min       -51
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            37122
_diffrn_reflns_theta_full        27.51
_diffrn_reflns_theta_max         27.51
_diffrn_reflns_theta_min         1.05
_exptl_absorpt_coefficient_mu    2.974
_exptl_absorpt_correction_T_max  0.5877
_exptl_absorpt_correction_T_min  0.5877
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   Scaleapck
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.434
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             4296
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_refine_diff_density_max         1.058
_refine_diff_density_min         -1.611
_refine_diff_density_rms         0.194
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.991
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1117
_refine_ls_number_reflns         21370
_refine_ls_number_restraints     28
_refine_ls_restrained_S_all      1.000
_refine_ls_R_factor_all          0.0771
_refine_ls_R_factor_gt           0.0421
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0545P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0990
_refine_ls_wR_factor_ref         0.1123
_reflns_number_gt                14690
_reflns_number_total             21370
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b604465b.txt
_cod_data_source_block           ldq10
_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.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        9827.5(3)
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               7007387
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 0.395602(5) -1.122592(18) 0.557786(8) 0.02376(6) Uani 1 1 d . . .
P1 P 0.40116(4) -1.16069(12) 0.46077(5) 0.0262(3) Uani 1 1 d . . .
C1B C 0.33869(14) -1.0666(6) 0.6505(2) 0.0395(14) Uani 1 1 d . . .
H1BA H 0.3361 -1.0634 0.6930 0.047 Uiso 1 1 calc R . .
H1BB H 0.3304 -0.9891 0.6314 0.047 Uiso 1 1 calc R . .
C1 C 0.35328(14) -1.0356(5) 0.5193(2) 0.0294(12) Uani 1 1 d . . .
C1A C 0.39412(14) -1.0266(5) 0.4133(2) 0.0354(14) Uani 1 1 d . . .
H1AA H 0.4045 -1.0400 0.3778 0.042 Uiso 1 1 calc R . .
H1AB H 0.3691 -1.0163 0.3979 0.042 Uiso 1 1 calc R . .
Pt2 Pt 0.109881(5) -0.768876(19) 0.232090(9) 0.03125(7) Uani 1 1 d . . .
P2 P 0.38453(4) -1.07940(13) 0.65118(5) 0.0268(3) Uani 1 1 d . . .
C2 C 0.32732(14) -0.9868(5) 0.4909(2) 0.0340(13) Uani 1 1 d . . .
C2B C 0.31565(15) -1.1649(6) 0.6185(3) 0.0464(16) Uani 1 1 d . . .
H2BA H 0.3173 -1.2361 0.6452 0.056 Uiso 1 1 calc R . .
H2BB H 0.3233 -1.1886 0.5814 0.056 Uiso 1 1 calc R . .
C2A C 0.40871(14) -0.9096(4) 0.4444(2) 0.0317(13) Uani 1 1 d . . .
H2AA H 0.4056 -0.9097 0.4866 0.038 Uiso 1 1 calc R . .
H2AB H 0.4336 -0.9059 0.4457 0.038 Uiso 1 1 calc R . .
P3 P 0.10262(4) -0.97006(13) 0.21047(7) 0.0363(4) Uani 1 1 d . . .
C3 C 0.29780(14) -0.9388(5) 0.4572(2) 0.0339(13) Uani 1 1 d . . .
C3B C 0.27855(18) -1.1223(7) 0.6018(4) 0.072(2) Uani 1 1 d . . .
H3BA H 0.2703 -1.1092 0.6395 0.086 Uiso 1 1 calc R . .
H3BB H 0.2778 -1.0441 0.5808 0.086 Uiso 1 1 calc R . .
C3A C 0.39132(18) -0.7985(5) 0.4117(2) 0.0437(16) Uani 1 1 d . . .
H3AA H 0.3664 -0.8038 0.4100 0.052 Uiso 1 1 calc R . .
H3AB H 0.3945 -0.7994 0.3696 0.052 Uiso 1 1 calc R . .
P4 P 0.11973(4) -0.57299(14) 0.26393(7) 0.0359(4) Uani 1 1 d . . .
C4 C 0.27158(15) -0.9031(5) 0.4263(2) 0.0390(14) Uani 1 1 d . . .
C4B C 0.2543(2) -1.2083(8) 0.5618(5) 0.126(5) Uani 1 1 d . . .
H4BA H 0.2628 -1.2903 0.5733 0.151 Uiso 1 1 calc R . .
H4BB H 0.2318 -1.2009 0.5733 0.151 Uiso 1 1 calc R . .
C4A C 0.40447(19) -0.6785(5) 0.4407(3) 0.0530(18) Uani 1 1 d . . .
H4AA H 0.4292 -0.6715 0.4408 0.064 Uiso 1 1 calc R . .
H4AB H 0.3924 -0.6128 0.4153 0.064 Uiso 1 1 calc R . .
C5 C 0.24063(15) -0.8702(5) 0.3906(3) 0.0411(15) Uani 1 1 d . . .
C5B C 0.2481(4) -1.2030(9) 0.5026(4) 0.173(7) Uani 1 1 d . . .
H5BA H 0.2702 -1.2166 0.4905 0.207 Uiso 1 1 calc R . .
H5BB H 0.2410 -1.1197 0.4908 0.207 Uiso 1 1 calc R . .
C5A C 0.39973(18) -0.6618(6) 0.5048(3) 0.0493(17) Uani 1 1 d . . .
H5AA H 0.4128 -0.7253 0.5306 0.059 Uiso 1 1 calc R . .
H5AB H 0.4098 -0.5836 0.5202 0.059 Uiso 1 1 calc R . .
C6 C 0.21297(15) -0.8488(5) 0.3588(3) 0.0387(14) Uani 1 1 d . . .
C6B C 0.2222(3) -1.2850(8) 0.4649(4) 0.114(4) Uani 1 1 d . . .
H6BA H 0.1988 -1.2547 0.4645 0.137 Uiso 1 1 calc R . .
H6BB H 0.2243 -1.3659 0.4834 0.137 Uiso 1 1 calc R . .
C6A C 0.36309(19) -0.6655(6) 0.5115(3) 0.0578(19) Uani 1 1 d . . .
H6AA H 0.3533 -0.7447 0.4974 0.069 Uiso 1 1 calc R . .
H6AB H 0.3499 -0.6038 0.4847 0.069 Uiso 1 1 calc R . .
C7 C 0.18160(15) -0.8268(5) 0.3229(2) 0.0364(14) Uani 1 1 d . . .
C7B C 0.2269(2) -1.2943(8) 0.3998(4) 0.097(3) Uani 1 1 d . . .
H7BA H 0.2518 -1.2970 0.4005 0.116 Uiso 1 1 calc R . .
H7BB H 0.2167 -1.3708 0.3821 0.116 Uiso 1 1 calc R . .
C7A C 0.35803(19) -0.6450(7) 0.5749(3) 0.069(2) Uani 1 1 d D . .
H7AA H 0.3723 -0.7047 0.6014 0.083 Uiso 1 1 calc R . .
H7AB H 0.3676 -0.5649 0.5879 0.083 Uiso 1 1 calc R . .
C8 C 0.15361(16) -0.8075(5) 0.2904(2) 0.0376(14) Uani 1 1 d . . .
C8B C 0.2118(2) -1.1979(7) 0.3617(4) 0.086(3) Uani 1 1 d . . .
H8BA H 0.2185 -1.1217 0.3837 0.104 Uiso 1 1 calc R . .
H8BB H 0.1866 -1.2051 0.3552 0.104 Uiso 1 1 calc R . .
C8A C 0.3241(2) -0.6504(16) 0.5871(4) 0.198(8) Uani 1 1 d D . .
C9B C 0.2214(2) -1.1883(8) 0.2982(4) 0.088(3) Uani 1 1 d . . .
H9BA H 0.2189 -1.2680 0.2784 0.106 Uiso 1 1 calc R . .
H9BB H 0.2054 -1.1321 0.2722 0.106 Uiso 1 1 calc R . .
C9A C 0.2955(2) -0.6150(13) 0.5511(5) 0.149(6) Uani 1 1 d D . .
C10B C 0.2582(2) -1.1442(8) 0.3045(4) 0.083(3) Uani 1 1 d . . .
H10A H 0.2610 -1.0663 0.3260 0.100 Uiso 1 1 calc R . .
H10B H 0.2742 -1.2024 0.3288 0.100 Uiso 1 1 calc R . .
C10A C 0.2615(3) -0.5930(13) 0.5586(6) 0.147(5) Uani 1 1 d D . .
C11 C 0.44030(13) -1.2163(4) 0.5951(2) 0.0244(11) Uani 1 1 d . . .
C11B C 0.2668(3) -1.1297(8) 0.2439(4) 0.098(3) Uani 1 1 d . . .
H11A H 0.2492 -1.0784 0.2182 0.118 Uiso 1 1 calc R . .
H11B H 0.2662 -1.2093 0.2242 0.118 Uiso 1 1 calc R . .
C11A C 0.2338(4) -0.6448(13) 0.5100(6) 0.186(7) Uani 1 1 d D . .
F12 F 0.41032(9) -1.3952(3) 0.60092(15) 0.0442(9) Uani 1 1 d . . .
C12 C 0.44041(14) -1.3336(5) 0.6117(2) 0.0288(12) Uani 1 1 d . . .
C12B C 0.3021(3) -1.0736(8) 0.2486(4) 0.092(3) Uani 1 1 d . . .
H12A H 0.3194 -1.1272 0.2734 0.110 Uiso 1 1 calc R . .
H12B H 0.3069 -1.0711 0.2075 0.110 Uiso 1 1 calc R . .
C12A C 0.2314(7) -0.7455(11) 0.5485(6) 0.48(3) Uani 1 1 d D . .
F13 F 0.46763(10) -1.5125(3) 0.65462(16) 0.0585(11) Uani 1 1 d . . .
C13 C 0.46916(17) -1.3961(5) 0.6380(2) 0.0372(15) Uani 1 1 d . . .
C13B C 0.3072(2) -0.9484(8) 0.2753(4) 0.078(2) Uani 1 1 d . . .
H13A H 0.3052 -0.9522 0.3180 0.093 Uiso 1 1 calc R . .
H13B H 0.3309 -0.9220 0.2751 0.093 Uiso 1 1 calc R . .
C13A C 0.1982(5) -0.787(3) 0.5170(11) 0.31(2) Uani 1 1 d D . .
F14 F 0.52962(10) -1.4019(3) 0.67265(17) 0.0626(11) Uani 1 1 d . . .
C14 C 0.50082(17) -1.3420(5) 0.6474(2) 0.0417(15) Uani 1 1 d . . .
C14B C 0.2825(2) -0.8550(6) 0.2431(3) 0.069(2) Uani 1 1 d . . .
H14A H 0.2591 -0.8749 0.2478 0.082 Uiso 1 1 calc R . .
H14B H 0.2825 -0.8568 0.1993 0.082 Uiso 1 1 calc R . .
C14A C 0.1733(10) -0.874(2) 0.5229(12) 0.32(2) Uani 1 1 d D . .
C15 C 0.50233(15) -1.2236(5) 0.6304(2) 0.0325(13) Uani 1 1 d . . .
F15 F 0.53295(8) -1.1676(3) 0.63814(15) 0.0502(9) Uani 1 1 d . . .
C15B C 0.2917(2) -0.7297(7) 0.2672(4) 0.076(2) Uani 1 1 d . . .
H15A H 0.2892 -0.7262 0.3097 0.091 Uiso 1 1 calc R . .
H15B H 0.3161 -0.7144 0.2672 0.091 Uiso 1 1 calc R . .
C15A C 0.1555(4) -0.986(2) 0.5140(7) 0.228(12) Uani 1 1 d D . .
F16 F 0.47626(8) -1.0489(3) 0.58838(13) 0.0365(8) Uani 1 1 d . . .
C16 C 0.47229(14) -1.1652(4) 0.6049(2) 0.0251(11) Uani 1 1 d . . .
C16B C 0.2703(2) -0.6314(7) 0.2320(4) 0.076(2) Uani 1 1 d . . .
H16A H 0.2799 -0.5529 0.2476 0.091 Uiso 1 1 calc R . .
H16B H 0.2719 -0.6371 0.1891 0.091 Uiso 1 1 calc R . .
C16A C 0.1220(6) -1.021(2) 0.4984(8) 0.272(12) Uani 1 1 d . . .
C17B C 0.23384(19) -0.6358(8) 0.2352(3) 0.078(3) Uani 1 1 d . . .
H17A H 0.2324 -0.6375 0.2783 0.093 Uiso 1 1 calc R . .
H17B H 0.2238 -0.7115 0.2164 0.093 Uiso 1 1 calc R . .
C17A C 0.0980(3) -1.0312(15) 0.4416(4) 0.159(6) Uani 1 1 d . . .
C18B C 0.21178(18) -0.5280(7) 0.2034(3) 0.063(2) Uani 1 1 d . . .
H18A H 0.2198 -0.4533 0.2257 0.076 Uiso 1 1 calc R . .
H18B H 0.2156 -0.5195 0.1619 0.076 Uiso 1 1 calc R . .
C18A C 0.1098(3) -1.0856(11) 0.3876(4) 0.123(4) Uani 1 1 d . . .
C19B C 0.17269(16) -0.5427(6) 0.2000(3) 0.0478(16) Uani 1 1 d . . .
H19A H 0.1600 -0.4859 0.1696 0.057 Uiso 1 1 calc R . .
H19B H 0.1657 -0.6250 0.1861 0.057 Uiso 1 1 calc R . .
C19A C 0.0948(2) -1.0140(7) 0.3304(3) 0.071(2) Uani 1 1 d . . .
C20B C 0.16250(15) -0.5206(5) 0.2604(3) 0.0428(15) Uani 1 1 d . . .
H20A H 0.1638 -0.4334 0.2688 0.051 Uiso 1 1 calc R . .
H20B H 0.1794 -0.5608 0.2928 0.051 Uiso 1 1 calc R . .
C20A C 0.10990(18) -1.0656(6) 0.2792(3) 0.0555(19) Uani 1 1 d . . .
C21 C 0.36878(14) -1.2668(5) 0.4226(2) 0.0310(13) Uani 1 1 d . . .
C22 C 0.36682(17) -1.2998(5) 0.3625(2) 0.0448(16) Uani 1 1 d . . .
H22A H 0.3824 -1.2662 0.3408 0.054 Uiso 1 1 calc R . .
C23 C 0.3428(2) -1.3795(6) 0.3351(3) 0.061(2) Uani 1 1 d . . .
H23A H 0.3415 -1.4010 0.2940 0.073 Uiso 1 1 calc R . .
C24 C 0.32026(19) -1.4295(6) 0.3659(3) 0.057(2) Uani 1 1 d . . .
H24A H 0.3036 -1.4857 0.3462 0.068 Uiso 1 1 calc R . .
C25 C 0.32158(17) -1.3993(5) 0.4242(3) 0.0492(17) Uani 1 1 d . . .
H25A H 0.3058 -1.4339 0.4453 0.059 Uiso 1 1 calc R . .
C26 C 0.34608(15) -1.3172(5) 0.4532(2) 0.0386(14) Uani 1 1 d . . .
H26A H 0.3471 -1.2962 0.4942 0.046 Uiso 1 1 calc R . .
C31 C 0.44158(14) -1.2278(5) 0.4527(2) 0.0270(12) Uani 1 1 d . . .
C32 C 0.44430(15) -1.3513(5) 0.4506(2) 0.0364(14) Uani 1 1 d . . .
H32A H 0.4248 -1.4001 0.4510 0.044 Uiso 1 1 calc R . .
C33 C 0.47519(17) -1.4036(5) 0.4479(3) 0.0435(16) Uani 1 1 d . . .
H33A H 0.4767 -1.4885 0.4454 0.052 Uiso 1 1 calc R . .
C34 C 0.50401(15) -1.3345(5) 0.4487(3) 0.0385(14) Uani 1 1 d . . .
H34A H 0.5254 -1.3713 0.4478 0.046 Uiso 1 1 calc R . .
C35 C 0.50135(15) -1.2104(5) 0.4510(2) 0.0379(14) Uani 1 1 d . . .
H35A H 0.5209 -1.1617 0.4510 0.045 Uiso 1 1 calc R . .
C36 C 0.47032(14) -1.1578(5) 0.4531(2) 0.0310(12) Uani 1 1 d . . .
H36A H 0.4687 -1.0729 0.4549 0.037 Uiso 1 1 calc R . .
C41 C 0.40177(15) -0.9344(5) 0.6787(2) 0.0315(13) Uani 1 1 d . . .
C42 C 0.38922(19) -0.8705(5) 0.7224(3) 0.0524(18) Uani 1 1 d . . .
H42A H 0.3713 -0.9030 0.7392 0.063 Uiso 1 1 calc R . .
C43 C 0.4031(2) -0.7591(6) 0.7411(3) 0.057(2) Uani 1 1 d . . .
H43A H 0.3942 -0.7147 0.7701 0.068 Uiso 1 1 calc R . .
C44 C 0.42936(19) -0.7122(6) 0.7187(3) 0.0517(18) Uani 1 1 d . . .
H44A H 0.4389 -0.6366 0.7326 0.062 Uiso 1 1 calc R . .
C45 C 0.44207(18) -0.7753(5) 0.6754(3) 0.0477(17) Uani 1 1 d . . .
H45A H 0.4605 -0.7437 0.6596 0.057 Uiso 1 1 calc R . .
C46 C 0.42750(16) -0.8848(5) 0.6555(3) 0.0401(15) Uani 1 1 d . . .
H46A H 0.4356 -0.9268 0.6248 0.048 Uiso 1 1 calc R . .
C51 C 0.40329(14) -1.1854(5) 0.7100(2) 0.0282(12) Uani 1 1 d . . .
C52 C 0.38962(15) -1.2988(5) 0.7102(2) 0.0353(14) Uani 1 1 d . . .
H52A H 0.3685 -1.3176 0.6832 0.042 Uiso 1 1 calc R . .
C53 C 0.40642(18) -1.3853(5) 0.7492(3) 0.0445(16) Uani 1 1 d . . .
H53A H 0.3966 -1.4630 0.7492 0.053 Uiso 1 1 calc R . .
C54 C 0.43701(18) -1.3603(6) 0.7880(3) 0.0490(18) Uani 1 1 d . . .
H54A H 0.4488 -1.4211 0.8138 0.059 Uiso 1 1 calc R . .
C55 C 0.45052(17) -1.2467(6) 0.7893(3) 0.0481(17) Uani 1 1 d . . .
H55A H 0.4713 -1.2278 0.8172 0.058 Uiso 1 1 calc R . .
C56 C 0.43393(15) -1.1600(5) 0.7501(2) 0.0383(14) Uani 1 1 d . . .
H56A H 0.4436 -1.0821 0.7507 0.046 Uiso 1 1 calc R . .
C61 C 0.06631(15) -0.7285(5) 0.1679(2) 0.0339(13) Uani 1 1 d . . .
F62 F 0.09339(10) -0.7626(3) 0.08729(16) 0.0611(11) Uani 1 1 d . . .
C62 C 0.06523(16) -0.7319(5) 0.1072(3) 0.0417(15) Uani 1 1 d . . .
F63 F 0.03705(12) -0.7115(4) 0.00349(16) 0.0822(14) Uani 1 1 d . . .
C63 C 0.0363(2) -0.7064(6) 0.0632(3) 0.0550(19) Uani 1 1 d . . .
F64 F -0.02163(12) -0.6513(5) 0.0371(2) 0.117(2) Uani 1 1 d . . .
C64 C 0.00630(19) -0.6776(7) 0.0800(3) 0.069(2) Uani 1 1 d . . .
C65 C 0.00593(18) -0.6725(8) 0.1397(3) 0.068(2) Uani 1 1 d . . .
F65 F -0.02276(12) -0.6424(6) 0.1569(2) 0.120(2) Uani 1 1 d . . .
F66 F 0.03300(9) -0.6913(4) 0.24097(15) 0.0619(11) Uani 1 1 d . . .
C66 C 0.03576(16) -0.6968(6) 0.1822(3) 0.0426(15) Uani 1 1 d . . .
C71 C 0.06084(15) -1.0103(5) 0.1638(3) 0.0382(14) Uani 1 1 d . . .
C72 C 0.05662(16) -1.0383(5) 0.1033(3) 0.0465(16) Uani 1 1 d . . .
H72A H 0.0761 -1.0424 0.0855 0.056 Uiso 1 1 calc R . .
C73 C 0.02437(19) -1.0604(6) 0.0684(3) 0.062(2) Uani 1 1 d . . .
H73A H 0.0217 -1.0809 0.0270 0.074 Uiso 1 1 calc R . .
C74 C -0.00407(17) -1.0529(6) 0.0934(3) 0.0554(19) Uani 1 1 d . . .
H74A H -0.0262 -1.0672 0.0689 0.066 Uiso 1 1 calc R . .
C75 C -0.00066(17) -1.0252(6) 0.1525(3) 0.0561(18) Uani 1 1 d . . .
H75A H -0.0204 -1.0204 0.1694 0.067 Uiso 1 1 calc R . .
C76 C 0.03163(16) -1.0038(5) 0.1887(3) 0.0472(16) Uani 1 1 d . . .
H76A H 0.0339 -0.9848 0.2303 0.057 Uiso 1 1 calc R . .
C81 C 0.13343(15) -1.0310(5) 0.1700(3) 0.0416(15) Uani 1 1 d . . .
C82 C 0.15733(17) -0.9573(7) 0.1540(3) 0.0557(18) Uani 1 1 d . . .
H82A H 0.1571 -0.8738 0.1624 0.067 Uiso 1 1 calc R . .
C83 C 0.1818(2) -1.0034(8) 0.1256(3) 0.077(2) Uani 1 1 d . . .
H83A H 0.1988 -0.9523 0.1156 0.093 Uiso 1 1 calc R . .
C84 C 0.1815(3) -1.1231(10) 0.1121(4) 0.099(3) Uani 1 1 d . . .
H84A H 0.1980 -1.1549 0.0918 0.119 Uiso 1 1 calc R . .
C85 C 0.1572(3) -1.1984(8) 0.1278(4) 0.086(3) Uani 1 1 d . . .
H85A H 0.1571 -1.2816 0.1186 0.103 Uiso 1 1 calc R . .
C86 C 0.1333(2) -1.1524(6) 0.1567(3) 0.061(2) Uani 1 1 d . . .
H86A H 0.1166 -1.2037 0.1676 0.073 Uiso 1 1 calc R . .
C91 C 0.08917(16) -0.4649(5) 0.2232(3) 0.0417(15) Uani 1 1 d . . .
C92 C 0.08523(17) -0.4568(5) 0.1618(3) 0.0505(17) Uani 1 1 d . . .
H92A H 0.1007 -0.4989 0.1427 0.061 Uiso 1 1 calc R . .
C93 C 0.0593(2) -0.3888(6) 0.1267(4) 0.067(2) Uani 1 1 d . . .
H93A H 0.0568 -0.3834 0.0841 0.081 Uiso 1 1 calc R . .
C94 C 0.0371(2) -0.3291(7) 0.1559(5) 0.081(3) Uani 1 1 d . . .
H94A H 0.0187 -0.2836 0.1328 0.097 Uiso 1 1 calc R . .
C95 C 0.0414(2) -0.3347(7) 0.2176(4) 0.076(2) Uani 1 1 d . . .
H95A H 0.0265 -0.2910 0.2372 0.091 Uiso 1 1 calc R . .
C96 C 0.06712(18) -0.4029(5) 0.2508(3) 0.0548(18) Uani 1 1 d . . .
H96A H 0.0698 -0.4077 0.2935 0.066 Uiso 1 1 calc R . .
C101 C 0.11763(16) -0.5538(6) 0.3427(3) 0.0459(16) Uani 1 1 d . . .
C102 C 0.10017(17) -0.6377(6) 0.3701(3) 0.0520(17) Uani 1 1 d . . .
H10C H 0.0893 -0.7041 0.3474 0.062 Uiso 1 1 calc R . .
C103 C 0.0986(2) -0.6248(7) 0.4305(3) 0.065(2) Uani 1 1 d . . .
H10D H 0.0866 -0.6827 0.4487 0.078 Uiso 1 1 calc R . .
C104 C 0.1139(2) -0.5310(10) 0.4637(4) 0.085(3) Uani 1 1 d . . .
H10E H 0.1127 -0.5229 0.5049 0.102 Uiso 1 1 calc R . .
C105 C 0.1308(3) -0.4499(10) 0.4377(4) 0.107(4) Uani 1 1 d . . .
H10F H 0.1418 -0.3851 0.4615 0.129 Uiso 1 1 calc R . .
C106 C 0.1328(2) -0.4567(7) 0.3764(3) 0.077(3) Uani 1 1 d . . .
H10G H 0.1443 -0.3963 0.3587 0.092 Uiso 1 1 calc R . .
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'
Pt Pt -1.7033 8.3905 '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
C1 Pt1 C11 177.87(19) . . ?
C1 Pt1 P1 85.41(15) . . ?
C11 Pt1 P1 92.47(13) . . ?
C1 Pt1 P2 89.21(15) . . ?
C11 Pt1 P2 92.90(13) . . ?
P1 Pt1 P2 174.40(5) . . ?
C1 Pt1 Pt2 12.94(14) . . ?
C11 Pt1 Pt2 165.34(13) . . ?
P1 Pt1 Pt2 76.40(4) . . ?
P2 Pt1 Pt2 98.03(4) . . ?
C31 P1 C21 103.8(2) . . ?
C31 P1 C1A 107.6(2) . . ?
C21 P1 C1A 104.4(2) . . ?
C31 P1 Pt1 116.37(15) . . ?
C21 P1 Pt1 111.52(19) . . ?
C1A P1 Pt1 112.20(17) . . ?
C2B C1B P2 116.7(4) . . ?
C2 C1 Pt1 174.4(5) . . ?
C2A C1A P1 115.5(3) . . ?
C8 Pt2 C61 176.6(2) . . ?
C8 Pt2 P3 88.98(16) . . ?
C61 Pt2 P3 90.84(15) . . ?
C8 Pt2 P4 86.11(17) . . ?
C61 Pt2 P4 94.26(15) . . ?
P3 Pt2 P4 174.04(5) . . ?
C8 Pt2 Pt1 7.41(17) . . ?
C61 Pt2 Pt1 170.11(16) . . ?
P3 Pt2 Pt1 82.96(4) . . ?
P4 Pt2 Pt1 92.38(4) . . ?
C41 P2 C51 105.3(2) . . ?
C41 P2 C1B 103.7(3) . . ?
C51 P2 C1B 108.0(3) . . ?
C41 P2 Pt1 111.55(18) . . ?
C51 P2 Pt1 113.97(17) . . ?
C1B P2 Pt1 113.57(17) . . ?
C1 C2 C3 176.4(6) . . ?
C1B C2B C3B 110.5(5) . . ?
C3A C2A C1A 112.3(4) . . ?
C81 P3 C71 104.5(3) . . ?
C81 P3 C20A 102.0(3) . . ?
C71 P3 C20A 107.5(3) . . ?
C81 P3 Pt2 113.8(2) . . ?
C71 P3 Pt2 114.81(19) . . ?
C20A P3 Pt2 113.0(2) . . ?
C4 C3 C2 176.3(7) . . ?
C4B C3B C2B 114.4(7) . . ?
C2A C3A C4A 115.0(5) . . ?
C101 P4 C91 104.5(3) . . ?
C101 P4 C20B 104.5(3) . . ?
C91 P4 C20B 107.3(3) . . ?
C101 P4 Pt2 112.2(2) . . ?
C91 P4 Pt2 114.79(19) . . ?
C20B P4 Pt2 112.8(2) . . ?
C3 C4 C5 176.0(7) . . ?
C5B C4B C3B 122.5(9) . . ?
C5A C4A C3A 114.5(5) . . ?
C6 C5 C4 176.0(7) . . ?
C4B C5B C6B 120.5(10) . . ?
C6A C5A C4A 114.9(6) . . ?
C5 C6 C7 178.9(7) . . ?
C5B C6B C7B 112.0(9) . . ?
C5A C6A C7A 115.2(6) . . ?
C8 C7 C6 179.5(7) . . ?
C8B C7B C6B 114.0(9) . . ?
C8A C7A C6A 120.1(7) . . ?
C7 C8 Pt2 175.0(5) . . ?
C7B C8B C9B 116.8(9) . . ?
C9A C8A C7A 126.5(11) . . ?
C10B C9B C8B 110.9(7) . . ?
C8A C9A C10A 134.4(12) . . ?
C11B C10B C9B 111.0(8) . . ?
C9A C10A C11A 114.6(13) . . ?
C12 C11 C16 114.1(5) . . ?
C12 C11 Pt1 123.0(4) . . ?
C16 C11 Pt1 122.9(4) . . ?
C10B C11B C12B 112.0(8) . . ?
C12A C11A C10A 89.5(14) . . ?
F12 C12 C11 119.1(5) . . ?
F12 C12 C13 116.6(5) . . ?
C11 C12 C13 124.3(5) . . ?
C13B C12B C11B 116.6(8) . . ?
C11A C12A C13A 97(2) . . ?
F13 C13 C12 121.7(6) . . ?
F13 C13 C14 118.2(5) . . ?
C12 C13 C14 120.1(5) . . ?
C14B C13B C12B 115.1(7) . . ?
C14A C13A C12A 140(4) . . ?
F14 C14 C13 121.4(5) . . ?
F14 C14 C15 120.5(6) . . ?
C13 C14 C15 118.1(5) . . ?
C13B C14B C15B 112.3(7) . . ?
C13A C14A C15A 157(3) . . ?
F15 C15 C16 121.1(5) . . ?
F15 C15 C14 120.0(5) . . ?
C16 C15 C14 118.9(5) . . ?
C16B C15B C14B 114.5(7) . . ?
C16A C15A C14A 136(3) . . ?
F16 C16 C11 120.6(4) . . ?
F16 C16 C15 114.9(5) . . ?
C11 C16 C15 124.5(5) . . ?
C17B C16B C15B 113.7(7) . . ?
C15A C16A C17A 133(2) . . ?
C16B C17B C18B 114.4(7) . . ?
C16A C17A C18A 119.1(13) . . ?
C19B C18B C17B 113.5(6) . . ?
C19A C18A C17A 109.9(10) . . ?
C20B C19B C18B 113.5(5) . . ?
C18A C19A C20A 107.5(7) . . ?
C19B C20B P4 115.0(4) . . ?
C19A C20A P3 113.8(5) . . ?
C26 C21 C22 118.7(5) . . ?
C26 C21 P1 120.2(4) . . ?
C22 C21 P1 121.1(5) . . ?
C23 C22 C21 120.2(6) . . ?
C22 C23 C24 120.7(6) . . ?
C25 C24 C23 120.4(6) . . ?
C24 C25 C26 119.9(6) . . ?
C21 C26 C25 120.1(5) . . ?
C32 C31 C36 119.3(5) . . ?
C32 C31 P1 119.3(4) . . ?
C36 C31 P1 121.2(4) . . ?
C33 C32 C31 120.1(6) . . ?
C32 C33 C34 121.0(6) . . ?
C33 C34 C35 119.1(6) . . ?
C36 C35 C34 120.0(6) . . ?
C35 C36 C31 120.6(5) . . ?
C46 C41 C42 118.8(5) . . ?
C46 C41 P2 119.2(4) . . ?
C42 C41 P2 122.0(5) . . ?
C43 C42 C41 119.4(6) . . ?
C44 C43 C42 121.2(6) . . ?
C43 C44 C45 119.9(6) . . ?
C46 C45 C44 118.9(6) . . ?
C41 C46 C45 121.9(6) . . ?
C52 C51 C56 118.6(5) . . ?
C52 C51 P2 120.0(4) . . ?
C56 C51 P2 120.9(4) . . ?
C51 C52 C53 120.4(6) . . ?
C54 C53 C52 120.7(6) . . ?
C53 C54 C55 119.5(6) . . ?
C54 C55 C56 120.0(6) . . ?
C55 C56 C51 120.7(6) . . ?
C62 C61 C66 114.1(5) . . ?
C62 C61 Pt2 122.8(5) . . ?
C66 C61 Pt2 123.1(4) . . ?
F62 C62 C61 119.9(5) . . ?
F62 C62 C63 116.1(6) . . ?
C61 C62 C63 124.0(6) . . ?
F63 C63 C64 119.7(6) . . ?
F63 C63 C62 120.9(7) . . ?
C64 C63 C62 119.4(6) . . ?
F64 C64 C65 121.6(7) . . ?
F64 C64 C63 119.2(7) . . ?
C65 C64 C63 119.1(6) . . ?
F65 C65 C64 119.9(6) . . ?
F65 C65 C66 120.8(7) . . ?
C64 C65 C66 119.3(7) . . ?
F66 C66 C61 120.5(5) . . ?
F66 C66 C65 115.4(6) . . ?
C61 C66 C65 124.0(6) . . ?
C72 C71 C76 118.5(5) . . ?
C72 C71 P3 121.9(5) . . ?
C76 C71 P3 119.3(5) . . ?
C73 C72 C71 120.4(7) . . ?
C74 C73 C72 120.4(7) . . ?
C75 C74 C73 120.4(6) . . ?
C74 C75 C76 120.2(7) . . ?
C75 C76 C71 120.0(6) . . ?
C82 C81 C86 119.9(7) . . ?
C82 C81 P3 119.8(5) . . ?
C86 C81 P3 120.3(6) . . ?
C81 C82 C83 120.4(7) . . ?
C84 C83 C82 119.5(9) . . ?
C83 C84 C85 120.4(9) . . ?
C86 C85 C84 119.7(8) . . ?
C85 C86 C81 120.0(8) . . ?
C92 C91 C96 119.2(6) . . ?
C92 C91 P4 118.4(5) . . ?
C96 C91 P4 121.9(5) . . ?
C91 C92 C93 121.6(7) . . ?
C94 C93 C92 117.8(8) . . ?
C95 C94 C93 120.8(8) . . ?
C96 C95 C94 120.0(8) . . ?
C95 C96 C91 120.6(8) . . ?
C106 C101 C102 118.8(6) . . ?
C106 C101 P4 121.7(5) . . ?
C102 C101 P4 119.5(5) . . ?
C103 C102 C101 120.2(7) . . ?
C104 C103 C102 121.0(8) . . ?
C105 C104 C103 119.2(8) . . ?
C104 C105 C106 122.5(8) . . ?
C101 C106 C105 118.2(8) . . ?
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 C1 1.978(5) . ?
Pt1 C11 2.081(5) . ?
Pt1 P1 2.2947(13) . ?
Pt1 P2 2.3031(13) . ?
Pt1 Pt2 12.781(3) . ?
P1 C31 1.823(6) . ?
P1 C21 1.825(5) . ?
P1 C1A 1.826(5) . ?
C1B C2B 1.510(8) . ?
C1B P2 1.832(6) . ?
C1 C2 1.222(7) . ?
C1A C2A 1.535(7) . ?
Pt2 C8 1.992(6) . ?
Pt2 C61 2.059(5) . ?
Pt2 P3 2.2995(15) . ?
Pt2 P4 2.3055(16) . ?
P2 C41 1.813(5) . ?
P2 C51 1.815(5) . ?
C2 C3 1.366(7) . ?
C2B C3B 1.522(9) . ?
C2A C3A 1.529(7) . ?
P3 C81 1.817(6) . ?
P3 C71 1.825(6) . ?
P3 C20A 1.855(6) . ?
C3 C4 1.193(7) . ?
C3B C4B 1.516(10) . ?
C3A C4A 1.531(8) . ?
P4 C101 1.817(6) . ?
P4 C91 1.817(6) . ?
P4 C20B 1.822(6) . ?
C4 C5 1.371(8) . ?
C4B C5B 1.310(13) . ?
C4A C5A 1.516(8) . ?
C5 C6 1.203(8) . ?
C5B C6B 1.500(12) . ?
C5A C6A 1.503(9) . ?
C6 C7 1.358(7) . ?
C6B C7B 1.529(12) . ?
C6A C7A 1.508(9) . ?
C7 C8 1.216(7) . ?
C7B C8B 1.427(10) . ?
C7A C8A 1.442(10) . ?
C8B C9B 1.570(11) . ?
C8A C9A 1.309(10) . ?
C9B C10B 1.526(11) . ?
C9A C10A 1.426(11) . ?
C10B C11B 1.492(11) . ?
C10A C11A 1.495(12) . ?
C11 C12 1.359(7) . ?
C11 C16 1.371(7) . ?
C11B C12B 1.526(12) . ?
C11A C12A 1.436(12) . ?
F12 C12 1.358(6) . ?
C12 C13 1.363(8) . ?
C12B C13B 1.517(11) . ?
C12A C13A 1.439(15) . ?
F13 C13 1.356(6) . ?
C13 C14 1.374(9) . ?
C13B C14B 1.508(9) . ?
C13A C14A 1.411(15) . ?
F14 C14 1.344(6) . ?
C14 C15 1.378(8) . ?
C14B C15B 1.514(9) . ?
C14A C15A 1.433(14) . ?
C15 F15 1.349(6) . ?
C15 C16 1.376(7) . ?
C15B C16B 1.506(10) . ?
C15A C16A 1.36(2) . ?
F16 C16 1.367(5) . ?
C16B C17B 1.474(10) . ?
C16A C17A 1.431(18) . ?
C17B C18B 1.568(10) . ?
C17A C18A 1.529(15) . ?
C18B C19B 1.554(8) . ?
C18A C19A 1.527(10) . ?
C19B C20B 1.528(8) . ?
C19A C20A 1.529(10) . ?
C21 C26 1.375(8) . ?
C21 C22 1.394(7) . ?
C22 C23 1.356(8) . ?
C23 C24 1.370(10) . ?
C24 C25 1.351(9) . ?
C25 C26 1.395(8) . ?
C31 C32 1.383(7) . ?
C31 C36 1.385(7) . ?
C32 C33 1.377(8) . ?
C33 C34 1.381(8) . ?
C34 C35 1.388(8) . ?
C35 C36 1.380(8) . ?
C41 C46 1.368(8) . ?
C41 C42 1.398(8) . ?
C42 C43 1.388(8) . ?
C43 C44 1.363(10) . ?
C44 C45 1.389(9) . ?
C45 C46 1.385(7) . ?
C51 C52 1.376(7) . ?
C51 C56 1.385(7) . ?
C52 C53 1.379(7) . ?
C53 C54 1.369(9) . ?
C54 C55 1.374(8) . ?
C55 C56 1.379(7) . ?
C61 C62 1.365(8) . ?
C61 C66 1.375(8) . ?
F62 C62 1.343(7) . ?
C62 C63 1.381(8) . ?
F63 C63 1.359(7) . ?
C63 C64 1.371(10) . ?
F64 C64 1.342(7) . ?
C64 C65 1.358(10) . ?
C65 F65 1.330(8) . ?
C65 C66 1.384(8) . ?
F66 C66 1.360(7) . ?
C71 C72 1.380(8) . ?
C71 C76 1.402(8) . ?
C72 C73 1.377(8) . ?
C73 C74 1.376(10) . ?
C74 C75 1.350(9) . ?
C75 C76 1.389(8) . ?
C81 C82 1.367(9) . ?
C81 C86 1.386(8) . ?
C82 C83 1.380(10) . ?
C83 C84 1.368(11) . ?
C84 C85 1.386(13) . ?
C85 C86 1.366(11) . ?
C91 C92 1.368(8) . ?
C91 C96 1.372(9) . ?
C92 C93 1.385(9) . ?
C93 C94 1.383(11) . ?
C94 C95 1.372(11) . ?
C95 C96 1.364(10) . ?
C101 C106 1.385(9) . ?
C101 C102 1.390(9) . ?
C102 C103 1.389(9) . ?
C103 C104 1.354(10) . ?
C104 C105 1.337(12) . ?
C105 C106 1.409(10) . ?
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
C1 Pt1 P1 C31 170.8(2) . . . . ?
C11 Pt1 P1 C31 -9.4(2) . . . . ?
P2 Pt1 P1 C31 -173.2(5) . . . . ?
Pt2 Pt1 P1 C31 -179.8(2) . . . . ?
C1 Pt1 P1 C21 -70.4(2) . . . . ?
C11 Pt1 P1 C21 109.3(2) . . . . ?
P2 Pt1 P1 C21 -54.4(6) . . . . ?
Pt2 Pt1 P1 C21 -61.02(18) . . . . ?
C1 Pt1 P1 C1A 46.3(2) . . . . ?
C11 Pt1 P1 C1A -133.9(2) . . . . ?
P2 Pt1 P1 C1A 62.3(6) . . . . ?
Pt2 Pt1 P1 C1A 55.7(2) . . . . ?
C11 Pt1 C1 C2 9(9) . . . . ?
P1 Pt1 C1 C2 15(5) . . . . ?
P2 Pt1 C1 C2 -163(5) . . . . ?
Pt2 Pt1 C1 C2 -30(5) . . . . ?
C31 P1 C1A C2A -90.6(4) . . . . ?
C21 P1 C1A C2A 159.6(4) . . . . ?
Pt1 P1 C1A C2A 38.7(5) . . . . ?
C1 Pt1 Pt2 C8 -15.8(15) . . . . ?
C11 Pt1 Pt2 C8 169.5(14) . . . . ?
P1 Pt1 Pt2 C8 -149.1(13) . . . . ?
P2 Pt1 Pt2 C8 31.6(13) . . . . ?
C1 Pt1 Pt2 C61 148.5(11) . . . . ?
C11 Pt1 Pt2 C61 -26.2(11) . . . . ?
P1 Pt1 Pt2 C61 15.3(9) . . . . ?
P2 Pt1 Pt2 C61 -164.0(9) . . . . ?
C1 Pt1 Pt2 P3 -159.9(7) . . . . ?
C11 Pt1 Pt2 P3 25.4(6) . . . . ?
P1 Pt1 Pt2 P3 66.87(6) . . . . ?
P2 Pt1 Pt2 P3 -112.48(6) . . . . ?
C1 Pt1 Pt2 P4 16.4(7) . . . . ?
C11 Pt1 Pt2 P4 -158.3(6) . . . . ?
P1 Pt1 Pt2 P4 -116.86(5) . . . . ?
P2 Pt1 Pt2 P4 63.79(5) . . . . ?
C2B C1B P2 C41 168.7(4) . . . . ?
C2B C1B P2 C51 -80.0(5) . . . . ?
C2B C1B P2 Pt1 47.4(5) . . . . ?
C1 Pt1 P2 C41 -86.5(2) . . . . ?
C11 Pt1 P2 C41 93.8(2) . . . . ?
P1 Pt1 P2 C41 -102.5(5) . . . . ?
Pt2 Pt1 P2 C41 -96.00(19) . . . . ?
C1 Pt1 P2 C51 154.5(2) . . . . ?
C11 Pt1 P2 C51 -25.2(2) . . . . ?
P1 Pt1 P2 C51 138.5(5) . . . . ?
Pt2 Pt1 P2 C51 145.0(2) . . . . ?
C1 Pt1 P2 C1B 30.3(3) . . . . ?
C11 Pt1 P2 C1B -149.4(3) . . . . ?
P1 Pt1 P2 C1B 14.3(6) . . . . ?
Pt2 Pt1 P2 C1B 20.8(2) . . . . ?
Pt1 C1 C2 C3 36(14) . . . . ?
P2 C1B C2B C3B -159.7(5) . . . . ?
P1 C1A C2A C3A -158.9(4) . . . . ?
C8 Pt2 P3 C81 -68.8(3) . . . . ?
C61 Pt2 P3 C81 107.8(3) . . . . ?
P4 Pt2 P3 C81 -103.2(6) . . . . ?
Pt1 Pt2 P3 C81 -64.4(2) . . . . ?
C8 Pt2 P3 C71 170.9(3) . . . . ?
C61 Pt2 P3 C71 -12.5(3) . . . . ?
P4 Pt2 P3 C71 136.4(6) . . . . ?
Pt1 Pt2 P3 C71 175.2(2) . . . . ?
C8 Pt2 P3 C20A 47.0(3) . . . . ?
C61 Pt2 P3 C20A -136.4(3) . . . . ?
P4 Pt2 P3 C20A 12.6(7) . . . . ?
Pt1 Pt2 P3 C20A 51.4(3) . . . . ?
C1 C2 C3 C4 7(18) . . . . ?
C1B C2B C3B C4B 171.8(7) . . . . ?
C1A C2A C3A C4A 179.5(5) . . . . ?
C8 Pt2 P4 C101 -65.8(3) . . . . ?
C61 Pt2 P4 C101 117.6(3) . . . . ?
P3 Pt2 P4 C101 -31.3(6) . . . . ?
Pt1 Pt2 P4 C101 -69.8(2) . . . . ?
C8 Pt2 P4 C91 175.0(3) . . . . ?
C61 Pt2 P4 C91 -1.6(3) . . . . ?
P3 Pt2 P4 C91 -150.4(6) . . . . ?
Pt1 Pt2 P4 C91 171.1(2) . . . . ?
C8 Pt2 P4 C20B 51.8(3) . . . . ?
C61 Pt2 P4 C20B -124.8(3) . . . . ?
P3 Pt2 P4 C20B 86.3(6) . . . . ?
Pt1 Pt2 P4 C20B 47.8(2) . . . . ?
C2 C3 C4 C5 22(18) . . . . ?
C2B C3B C4B C5B -90.1(14) . . . . ?
C2A C3A C4A C5A -60.9(8) . . . . ?
C3 C4 C5 C6 -5(18) . . . . ?
C3B C4B C5B C6B -176.1(10) . . . . ?
C3A C4A C5A C6A -60.6(8) . . . . ?
C4 C5 C6 C7 1(45) . . . . ?
C4B C5B C6B C7B -161.4(13) . . . . ?
C4A C5A C6A C7A -178.2(6) . . . . ?
C5 C6 C7 C8 -78(100) . . . . ?
C5B C6B C7B C8B -81.9(12) . . . . ?
C5A C6A C7A C8A -178.0(10) . . . . ?
C6 C7 C8 Pt2 -44(99) . . . . ?
C61 Pt2 C8 C7 24(9) . . . . ?
P3 Pt2 C8 C7 111(6) . . . . ?
P4 Pt2 C8 C7 -73(6) . . . . ?
Pt1 Pt2 C8 C7 75(6) . . . . ?
C6B C7B C8B C9B 169.0(8) . . . . ?
C6A C7A C8A C9A -35(2) . . . . ?
C7B C8B C9B C10B -72.9(10) . . . . ?
C7A C8A C9A C10A -166.5(15) . . . . ?
C8B C9B C10B C11B -177.4(7) . . . . ?
C8A C9A C10A C11A -134(2) . . . . ?
C1 Pt1 C11 C12 -88(6) . . . . ?
P1 Pt1 C11 C12 -94.7(4) . . . . ?
P2 Pt1 C11 C12 83.8(4) . . . . ?
Pt2 Pt1 C11 C12 -54.5(8) . . . . ?
C1 Pt1 C11 C16 91(6) . . . . ?
P1 Pt1 C11 C16 85.0(4) . . . . ?
P2 Pt1 C11 C16 -96.6(4) . . . . ?
Pt2 Pt1 C11 C16 125.1(5) . . . . ?
C9B C10B C11B C12B 174.2(7) . . . . ?
C9A C10A C11A C12A 98.4(14) . . . . ?
C16 C11 C12 F12 -176.3(4) . . . . ?
Pt1 C11 C12 F12 3.4(6) . . . . ?
C16 C11 C12 C13 2.4(7) . . . . ?
Pt1 C11 C12 C13 -177.9(4) . . . . ?
C10B C11B C12B C13B -61.5(11) . . . . ?
C10A C11A C12A C13A 162.1(16) . . . . ?
F12 C12 C13 F13 -2.6(7) . . . . ?
C11 C12 C13 F13 178.7(5) . . . . ?
F12 C12 C13 C14 176.5(5) . . . . ?
C11 C12 C13 C14 -2.2(8) . . . . ?
C11B C12B C13B C14B -57.2(11) . . . . ?
C11A C12A C13A C14A -174(4) . . . . ?
F13 C13 C14 F14 -0.3(8) . . . . ?
C12 C13 C14 F14 -179.4(5) . . . . ?
F13 C13 C14 C15 -180.0(5) . . . . ?
C12 C13 C14 C15 0.9(8) . . . . ?
C12B C13B C14B C15B -173.1(7) . . . . ?
C12A C13A C14A C15A -95(8) . . . . ?
F14 C14 C15 F15 1.3(8) . . . . ?
C13 C14 C15 F15 -179.1(5) . . . . ?
F14 C14 C15 C16 -179.8(5) . . . . ?
C13 C14 C15 C16 -0.1(8) . . . . ?
C13B C14B C15B C16B 173.3(7) . . . . ?
C13A C14A C15A C16A -132(9) . . . . ?
C12 C11 C16 F16 177.7(4) . . . . ?
Pt1 C11 C16 F16 -2.0(6) . . . . ?
C12 C11 C16 C15 -1.5(7) . . . . ?
Pt1 C11 C16 C15 178.8(4) . . . . ?
F15 C15 C16 F16 0.2(7) . . . . ?
C14 C15 C16 F16 -178.7(4) . . . . ?
F15 C15 C16 C11 179.4(5) . . . . ?
C14 C15 C16 C11 0.5(8) . . . . ?
C14B C15B C16B C17B 65.7(10) . . . . ?
C14A C15A C16A C17A 81(4) . . . . ?
C15B C16B C17B C18B 175.1(6) . . . . ?
C15A C16A C17A C18A 43(4) . . . . ?
C16B C17B C18B C19B 172.5(6) . . . . ?
C16A C17A C18A C19A -138.8(16) . . . . ?
C17B C18B C19B C20B 75.3(8) . . . . ?
C17A C18A C19A C20A 175.2(8) . . . . ?
C18B C19B C20B P4 -165.1(5) . . . . ?
C101 P4 C20B C19B 172.3(5) . . . . ?
C91 P4 C20B C19B -77.2(5) . . . . ?
Pt2 P4 C20B C19B 50.2(5) . . . . ?
C18A C19A C20A P3 -167.1(6) . . . . ?
C81 P3 C20A C19A 163.8(5) . . . . ?
C71 P3 C20A C19A -86.6(6) . . . . ?
Pt2 P3 C20A C19A 41.2(6) . . . . ?
C31 P1 C21 C26 123.1(5) . . . . ?
C1A P1 C21 C26 -124.3(5) . . . . ?
Pt1 P1 C21 C26 -2.9(5) . . . . ?
C31 P1 C21 C22 -56.0(5) . . . . ?
C1A P1 C21 C22 56.6(5) . . . . ?
Pt1 P1 C21 C22 178.0(4) . . . . ?
C26 C21 C22 C23 0.4(9) . . . . ?
P1 C21 C22 C23 179.5(5) . . . . ?
C21 C22 C23 C24 -0.5(11) . . . . ?
C22 C23 C24 C25 0.5(12) . . . . ?
C23 C24 C25 C26 -0.3(11) . . . . ?
C22 C21 C26 C25 -0.3(9) . . . . ?
P1 C21 C26 C25 -179.3(5) . . . . ?
C24 C25 C26 C21 0.2(10) . . . . ?
C21 P1 C31 C32 -31.1(4) . . . . ?
C1A P1 C31 C32 -141.4(4) . . . . ?
Pt1 P1 C31 C32 91.8(4) . . . . ?
C21 P1 C31 C36 153.8(4) . . . . ?
C1A P1 C31 C36 43.5(4) . . . . ?
Pt1 P1 C31 C36 -83.3(4) . . . . ?
C36 C31 C32 C33 -1.1(8) . . . . ?
P1 C31 C32 C33 -176.3(4) . . . . ?
C31 C32 C33 C34 1.6(8) . . . . ?
C32 C33 C34 C35 -1.4(8) . . . . ?
C33 C34 C35 C36 0.9(8) . . . . ?
C34 C35 C36 C31 -0.5(8) . . . . ?
C32 C31 C36 C35 0.6(7) . . . . ?
P1 C31 C36 C35 175.7(4) . . . . ?
C51 P2 C41 C46 103.1(5) . . . . ?
C1B P2 C41 C46 -143.6(5) . . . . ?
Pt1 P2 C41 C46 -20.9(5) . . . . ?
C51 P2 C41 C42 -77.8(5) . . . . ?
C1B P2 C41 C42 35.5(5) . . . . ?
Pt1 P2 C41 C42 158.1(4) . . . . ?
C46 C41 C42 C43 -0.1(9) . . . . ?
P2 C41 C42 C43 -179.1(5) . . . . ?
C41 C42 C43 C44 -1.6(11) . . . . ?
C42 C43 C44 C45 1.4(11) . . . . ?
C43 C44 C45 C46 0.5(10) . . . . ?
C42 C41 C46 C45 1.9(9) . . . . ?
P2 C41 C46 C45 -179.0(5) . . . . ?
C44 C45 C46 C41 -2.2(9) . . . . ?
C41 P2 C51 C52 164.8(4) . . . . ?
C1B P2 C51 C52 54.5(5) . . . . ?
Pt1 P2 C51 C52 -72.6(5) . . . . ?
C41 P2 C51 C56 -23.9(5) . . . . ?
C1B P2 C51 C56 -134.1(5) . . . . ?
Pt1 P2 C51 C56 98.7(5) . . . . ?
C56 C51 C52 C53 -0.7(8) . . . . ?
P2 C51 C52 C53 170.8(4) . . . . ?
C51 C52 C53 C54 -0.5(9) . . . . ?
C52 C53 C54 C55 2.1(9) . . . . ?
C53 C54 C55 C56 -2.4(10) . . . . ?
C54 C55 C56 C51 1.2(10) . . . . ?
C52 C51 C56 C55 0.3(9) . . . . ?
P2 C51 C56 C55 -171.1(5) . . . . ?
C8 Pt2 C61 C62 12(4) . . . . ?
P3 Pt2 C61 C62 -74.6(5) . . . . ?
P4 Pt2 C61 C62 108.5(5) . . . . ?
Pt1 Pt2 C61 C62 -23.5(13) . . . . ?
C8 Pt2 C61 C66 -168(3) . . . . ?
P3 Pt2 C61 C66 104.9(5) . . . . ?
P4 Pt2 C61 C66 -72.0(5) . . . . ?
Pt1 Pt2 C61 C66 155.9(7) . . . . ?
C66 C61 C62 F62 -179.5(5) . . . . ?
Pt2 C61 C62 F62 0.0(8) . . . . ?
C66 C61 C62 C63 -0.2(9) . . . . ?
Pt2 C61 C62 C63 179.4(5) . . . . ?
F62 C62 C63 F63 -0.7(10) . . . . ?
C61 C62 C63 F63 180.0(6) . . . . ?
F62 C62 C63 C64 178.2(7) . . . . ?
C61 C62 C63 C64 -1.1(11) . . . . ?
F63 C63 C64 F64 -2.0(12) . . . . ?
C62 C63 C64 F64 179.1(7) . . . . ?
F63 C63 C64 C65 -179.8(7) . . . . ?
C62 C63 C64 C65 1.3(13) . . . . ?
F64 C64 C65 F65 0.9(14) . . . . ?
C63 C64 C65 F65 178.7(8) . . . . ?
F64 C64 C65 C66 -177.9(7) . . . . ?
C63 C64 C65 C66 -0.2(13) . . . . ?
C62 C61 C66 F66 179.2(5) . . . . ?
Pt2 C61 C66 F66 -0.3(8) . . . . ?
C62 C61 C66 C65 1.4(10) . . . . ?
Pt2 C61 C66 C65 -178.2(6) . . . . ?
F65 C65 C66 F66 2.0(11) . . . . ?
C64 C65 C66 F66 -179.2(7) . . . . ?
F65 C65 C66 C61 179.9(7) . . . . ?
C64 C65 C66 C61 -1.2(13) . . . . ?
C81 P3 C71 C72 -20.9(6) . . . . ?
C20A P3 C71 C72 -128.8(5) . . . . ?
Pt2 P3 C71 C72 104.5(5) . . . . ?
C81 P3 C71 C76 164.1(5) . . . . ?
C20A P3 C71 C76 56.2(5) . . . . ?
Pt2 P3 C71 C76 -70.5(5) . . . . ?
C76 C71 C72 C73 -0.6(9) . . . . ?
P3 C71 C72 C73 -175.6(5) . . . . ?
C71 C72 C73 C74 1.0(10) . . . . ?
C72 C73 C74 C75 -0.8(11) . . . . ?
C73 C74 C75 C76 0.1(11) . . . . ?
C74 C75 C76 C71 0.3(10) . . . . ?
C72 C71 C76 C75 -0.1(9) . . . . ?
P3 C71 C76 C75 175.1(5) . . . . ?
C71 P3 C81 C82 124.2(5) . . . . ?
C20A P3 C81 C82 -123.9(5) . . . . ?
Pt2 P3 C81 C82 -1.8(6) . . . . ?
C71 P3 C81 C86 -57.3(5) . . . . ?
C20A P3 C81 C86 54.5(6) . . . . ?
Pt2 P3 C81 C86 176.6(4) . . . . ?
C86 C81 C82 C83 -1.3(10) . . . . ?
P3 C81 C82 C83 177.1(5) . . . . ?
C81 C82 C83 C84 1.8(12) . . . . ?
C82 C83 C84 C85 -1.3(14) . . . . ?
C83 C84 C85 C86 0.4(15) . . . . ?
C84 C85 C86 C81 0.1(13) . . . . ?
C82 C81 C86 C85 0.3(10) . . . . ?
P3 C81 C86 C85 -178.1(6) . . . . ?
C101 P4 C91 C92 179.2(5) . . . . ?
C20B P4 C91 C92 68.6(5) . . . . ?
Pt2 P4 C91 C92 -57.5(6) . . . . ?
C101 P4 C91 C96 -9.2(6) . . . . ?
C20B P4 C91 C96 -119.8(5) . . . . ?
Pt2 P4 C91 C96 114.1(5) . . . . ?
C96 C91 C92 C93 -0.8(10) . . . . ?
P4 C91 C92 C93 171.1(5) . . . . ?
C91 C92 C93 C94 -0.3(10) . . . . ?
C92 C93 C94 C95 1.8(12) . . . . ?
C93 C94 C95 C96 -2.2(13) . . . . ?
C94 C95 C96 C91 1.1(12) . . . . ?
C92 C91 C96 C95 0.4(10) . . . . ?
P4 C91 C96 C95 -171.1(5) . . . . ?
C91 P4 C101 C106 -75.6(6) . . . . ?
C20B P4 C101 C106 37.0(7) . . . . ?
Pt2 P4 C101 C106 159.4(6) . . . . ?
C91 P4 C101 C102 103.9(6) . . . . ?
C20B P4 C101 C102 -143.5(5) . . . . ?
Pt2 P4 C101 C102 -21.1(6) . . . . ?
C106 C101 C102 C103 -1.1(10) . . . . ?
P4 C101 C102 C103 179.4(5) . . . . ?
C101 C102 C103 C104 0.0(11) . . . . ?
C102 C103 C104 C105 0.0(14) . . . . ?
C103 C104 C105 C106 1.1(16) . . . . ?
C102 C101 C106 C105 2.1(12) . . . . ?
P4 C101 C106 C105 -178.4(7) . . . . ?
C104 C105 C106 C101 -2.2(16) . . . . ?
