#------------------------------------------------------------------------------
#$Date: 2015-07-05 11:26:40 +0300 (Sun, 05 Jul 2015) $
#$Revision: 140095 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/31/4343103.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_4343103
loop_
_publ_author_name
'Bonakdarzadeh, Pia'
'Topić, Filip'
'Kalenius, Elina'
'Bhowmik, Sandip'
'Sato, Sota'
'Groessl, Michael'
'Knochenmuss, Richard'
'Rissanen, Kari'
_publ_section_title
;
 DOSY NMR, X-ray Structural and Ion-Mobility Mass Spectrometric Studies on
 Electron-Deficient and Electron-Rich M6L4 Coordination Cages.
;
_journal_issue                   12
_journal_name_full               'Inorganic chemistry'
_journal_page_first              6055
_journal_page_last               6061
_journal_paper_doi               10.1021/acs.inorgchem.5b01082
_journal_volume                  54
_journal_year                    2015
_chemical_formula_moiety         'C282 H240 N12 O12 P12 Pt6, 4(C F3 O3 S)'
_chemical_formula_sum            'C286 H240 F12 N12 O24 P12 Pt6 S4'
_chemical_formula_weight         6127.31
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                91.33(3)
_cell_angle_beta                 106.35(3)
_cell_angle_gamma                118.99(3)
_cell_formula_units_Z            2
_cell_length_a                   27.009(5)
_cell_length_b                   27.449(6)
_cell_length_c                   44.478(9)
_cell_measurement_temperature    293(2)
_cell_volume                     27171(15)
_computing_cell_refinement       'HKL2000 (Otwinowski & Minor 1997)'
_computing_data_collection       'KEK ugui'
_computing_data_reduction        'HKL2000 (Otwinowski & Minor 1997)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2008)'
_computing_structure_solution    'Superflip (Palatinus & Chapuis, 2007)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector                 CMOS
_diffrn_detector_area_resol_mean 5.81
_diffrn_detector_type            'Dectris PILATUS 2M-F'
_diffrn_measured_fraction_theta_full 0.904
_diffrn_measured_fraction_theta_max 0.904
_diffrn_radiation_monochromator  Si(111)
_diffrn_radiation_probe          x-ray
_diffrn_radiation_wavelength     0.96000
_diffrn_reflns_av_R_equivalents  0.0546
_diffrn_reflns_av_unetI/netI     0.0711
_diffrn_reflns_laue_measured_fraction_full 0.904
_diffrn_reflns_laue_measured_fraction_max 0.904
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       28
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       46
_diffrn_reflns_limit_l_min       -46
_diffrn_reflns_number            103698
_diffrn_reflns_point_group_measured_fraction_full 0.904
_diffrn_reflns_point_group_measured_fraction_max 0.904
_diffrn_reflns_theta_full        29.999
_diffrn_reflns_theta_max         29.999
_diffrn_reflns_theta_min         1.167
_diffrn_source                   synchrotron
_diffrn_source_type              'KEK Photon Factory beamline BL1A'
_exptl_absorpt_coefficient_mu    2.341
_exptl_absorpt_correction_type   semi-empirical
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    0.749
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             6104
_exptl_crystal_size_max          0.500
_exptl_crystal_size_mid          0.300
_exptl_crystal_size_min          0.050
_refine_diff_density_max         0.979
_refine_diff_density_min         -0.938
_refine_diff_density_rms         0.068
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.957
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     2617
_refine_ls_number_reflns         58156
_refine_ls_number_restraints     8292
_refine_ls_restrained_S_all      0.945
_refine_ls_R_factor_all          0.0813
_refine_ls_R_factor_gt           0.0649
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1286P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1960
_refine_ls_wR_factor_ref         0.2107
_reflns_Friedel_coverage         0.000
_reflns_number_gt                36074
_reflns_number_total             58156
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ic5b01082_si_003.cif
_cod_data_source_block           2a
_cod_depositor_comments
'Adding full bibliography for 4343103--4343105.cif.'
_cod_original_cell_volume        27171(12)
_cod_database_code               4343103
_shelx_shelxl_version_number     2014/7
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.387
_shelx_estimated_absorpt_t_max   0.892
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
Pt1 Pt -0.14811(2) 0.30560(2) 0.09408(2) 0.14033(15) Uani 1 1 d . U
Pt2 Pt 0.17298(2) 0.08215(2) 0.45174(2) 0.13303(14) Uani 1 1 d . U
Pt3 Pt 0.35917(2) 0.77958(2) 0.45187(2) 0.13276(14) Uani 1 1 d . U
Pt4 Pt 0.36774(2) 0.04605(2) 0.09659(2) 0.13252(14) Uani 1 1 d . U
Pt5 Pt 0.55942(2) 0.75144(2) 0.08976(2) 0.15422(17) Uani 1 1 d . U
Pt6 Pt 0.87142(2) 0.58866(2) 0.44980(2) 0.13219(14) Uani 1 1 d . U
N1_1 N -0.0998(3) 0.3153(3) 0.14150(14) 0.138(2) Uani 1 1 d D U
C2_1 C -0.1064(3) 0.2704(3) 0.15442(16) 0.155(3) Uani 1 1 d D U
H2_1 H -0.1334 0.2345 0.1417 0.186 Uiso 1 1 calc R U
C3_1 C -0.0755(3) 0.2740(3) 0.18551(16) 0.176(4) Uani 1 1 d D U
H3_1 H -0.0814 0.2413 0.1936 0.211 Uiso 1 1 calc R U
C4_1 C -0.0357(4) 0.3268(3) 0.20453(15) 0.168(3) Uani 1 1 d D U
C5_1 C -0.0289(4) 0.3735(3) 0.19115(18) 0.183(4) Uani 1 1 d D U
H5_1 H -0.0030 0.4098 0.2035 0.220 Uiso 1 1 calc R U
C6_1 C -0.0603(4) 0.3662(3) 0.15968(17) 0.164(3) Uani 1 1 d D U
H6_1 H -0.0538 0.3982 0.1507 0.196 Uiso 1 1 calc R U
C7_1 C -0.0018(4) 0.3337(4) 0.23763(16) 0.186(4) Uani 1 1 d D U
C8_1 C 0.0281(4) 0.3420(4) 0.26426(15) 0.180(4) Uani 1 1 d D U
C25_1 C 0.0627(2) 0.3536(2) 0.29756(8) 0.165(3) Uani 1 1 d DG U
C26_1 C 0.0653(2) 0.31066(16) 0.31258(10) 0.161(3) Uani 1 1 d DG U
O31_1 O 0.0346(4) 0.2567(3) 0.29534(17) 0.212(3) Uani 1 1 d D U
C34_1 C 0.0095(12) 0.2118(6) 0.3097(5) 0.456(15) Uani 1 1 d D U
H34A_1 H -0.0103 0.1771 0.2945 0.684 Uiso 1 1 calc R U
H34B_1 H 0.0404 0.2124 0.3272 0.684 Uiso 1 1 calc R U
H34C_1 H -0.0191 0.2141 0.3174 0.684 Uiso 1 1 calc R U
N9_1 N 0.1451(3) 0.1343(3) 0.42803(15) 0.1339(19) Uani 1 1 d D U
C10_1 C 0.1680(4) 0.1875(3) 0.44083(18) 0.170(4) Uani 1 1 d D U
H10_1 H 0.1921 0.2002 0.4622 0.204 Uiso 1 1 calc R U
C11_1 C 0.1581(4) 0.2252(3) 0.42443(17) 0.173(4) Uani 1 1 d D U
H11_1 H 0.1770 0.2630 0.4342 0.208 Uiso 1 1 calc R U
C12_1 C 0.1202(4) 0.2070(3) 0.39346(17) 0.148(3) Uani 1 1 d D U
C13_1 C 0.0967(5) 0.1516(3) 0.38006(19) 0.177(4) Uani 1 1 d D U
H13_1 H 0.0710 0.1375 0.3590 0.213 Uiso 1 1 calc R U
C14_1 C 0.1109(4) 0.1167(3) 0.39748(18) 0.158(3) Uani 1 1 d D U
H14_1 H 0.0961 0.0798 0.3876 0.189 Uiso 1 1 calc R U
C15_1 C 0.1086(5) 0.2457(3) 0.37531(19) 0.167(4) Uani 1 1 d D U
C16_1 C 0.1029(4) 0.2791(3) 0.36091(19) 0.161(3) Uani 1 1 d D U
C27_1 C 0.1006(2) 0.32321(18) 0.34441(10) 0.142(3) Uani 1 1 d DG U
C28_1 C 0.1334(2) 0.3787(2) 0.36123(8) 0.143(3) Uani 1 1 d DG U
O32_1 O 0.1670(3) 0.3912(3) 0.39237(11) 0.170(2) Uani 1 1 d D U
C35_1 C 0.2267(4) 0.4074(6) 0.3993(3) 0.217(5) Uani 1 1 d D U
H35A_1 H 0.2458 0.4151 0.4220 0.326 Uiso 1 1 calc R U
H35B_1 H 0.2293 0.3774 0.3897 0.326 Uiso 1 1 calc R U
H35C_1 H 0.2465 0.4410 0.3909 0.326 Uiso 1 1 calc R U
N17_1 N 0.3027(3) 0.6955(3) 0.42717(15) 0.141(2) Uani 1 1 d D U
C18_1 C 0.2593(3) 0.6818(3) 0.40012(17) 0.163(3) Uani 1 1 d D U
H18_1 H 0.2528 0.7099 0.3921 0.196 Uiso 1 1 calc R U
C19_1 C 0.2233(3) 0.6271(3) 0.38331(17) 0.162(3) Uani 1 1 d D U
H19_1 H 0.1941 0.6190 0.3637 0.194 Uiso 1 1 calc R U
C20_1 C 0.2304(4) 0.5843(3) 0.39535(17) 0.150(3) Uani 1 1 d D U
C21_1 C 0.2767(4) 0.5992(3) 0.42349(18) 0.158(3) Uani 1 1 d D U
H21_1 H 0.2842 0.5719 0.4321 0.190 Uiso 1 1 calc R U
C22_1 C 0.3115(4) 0.6548(3) 0.43850(19) 0.160(3) Uani 1 1 d D U
H22_1 H 0.3428 0.6647 0.4575 0.193 Uiso 1 1 calc R U
C23_1 C 0.1940(4) 0.5264(3) 0.3778(2) 0.158(3) Uani 1 1 d D U
C24_1 C 0.1647(4) 0.4792(3) 0.36390(18) 0.154(3) Uani 1 1 d D U
C29_1 C 0.1308(2) 0.42170(16) 0.34621(10) 0.149(3) Uani 1 1 d DG U
C30_1 C 0.0955(2) 0.40914(18) 0.31438(11) 0.158(3) Uani 1 1 d DG U
O33_1 O 0.0903(4) 0.4506(3) 0.30020(17) 0.215(3) Uani 1 1 d D U
C36_1 C 0.1312(9) 0.4811(9) 0.2853(5) 0.381(12) Uani 1 1 d D U
H36A_1 H 0.1229 0.5089 0.2762 0.572 Uiso 1 1 calc R U
H36B_1 H 0.1711 0.4998 0.3005 0.572 Uiso 1 1 calc R U
H36C_1 H 0.1280 0.4558 0.2686 0.572 Uiso 1 1 calc R U
N1_2 N -0.0761(3) 0.3100(3) 0.08381(15) 0.141(2) Uani 1 1 d D U
C2_2 C -0.0290(4) 0.3579(4) 0.0838(2) 0.181(4) Uani 1 1 d D U
H2_2 H -0.0309 0.3907 0.0858 0.217 Uiso 1 1 calc R U
C3_2 C 0.0228(4) 0.3636(4) 0.0810(2) 0.209(5) Uani 1 1 d D U
H3_2 H 0.0559 0.3992 0.0832 0.251 Uiso 1 1 calc R U
C4_2 C 0.0242(4) 0.3149(4) 0.0748(3) 0.190(4) Uani 1 1 d D U
C5_2 C -0.0239(4) 0.2648(4) 0.0758(3) 0.190(4) Uani 1 1 d D U
H5_2 H -0.0241 0.2311 0.0727 0.228 Uiso 1 1 calc R U
C6_2 C -0.0715(4) 0.2643(4) 0.0814(2) 0.169(3) Uani 1 1 d D U
H6_2 H -0.1020 0.2302 0.0835 0.203 Uiso 1 1 calc R U
C7_2 C 0.0794(4) 0.3205(5) 0.0738(3) 0.228(6) Uani 1 1 d D U
C8_2 C 0.1242(4) 0.3249(5) 0.0729(3) 0.223(5) Uani 1 1 d D U
C25_2 C 0.1800(2) 0.3312(3) 0.07233(15) 0.186(4) Uani 1 1 d DG U
C26_2 C 0.2259(3) 0.3850(2) 0.07265(15) 0.213(5) Uani 1 1 d DG U
O31_2 O 0.2168(4) 0.4293(3) 0.0741(3) 0.260(4) Uani 1 1 d D U
C34_2 C 0.1815(12) 0.4353(10) 0.0472(5) 0.421(14) Uani 1 1 d D U
H34A_2 H 0.1793 0.4684 0.0520 0.631 Uiso 1 1 calc R U
H34B_2 H 0.1986 0.4394 0.0306 0.631 Uiso 1 1 calc R U
H34C_2 H 0.1418 0.4024 0.0403 0.631 Uiso 1 1 calc R U
N9_2 N 0.4972(4) 0.6663(3) 0.08390(16) 0.152(2) Uani 1 1 d D U
C10_2 C 0.5120(4) 0.6268(4) 0.08867(19) 0.181(4) Uani 1 1 d D U
H10_2 H 0.5523 0.6377 0.0937 0.218 Uiso 1 1 calc R U
C11_2 C 0.4713(4) 0.5710(4) 0.0866(2) 0.187(4) Uani 1 1 d D U
H11_2 H 0.4836 0.5448 0.0907 0.224 Uiso 1 1 calc R U
C12_2 C 0.4119(4) 0.5547(3) 0.0782(3) 0.185(4) Uani 1 1 d D U
C13_2 C 0.3958(4) 0.5956(4) 0.0745(3) 0.181(4) Uani 1 1 d D U
H13_2 H 0.3562 0.5862 0.0706 0.218 Uiso 1 1 calc R U
C14_2 C 0.4399(4) 0.6502(4) 0.0767(2) 0.161(3) Uani 1 1 d D U
H14_2 H 0.4290 0.6774 0.0730 0.193 Uiso 1 1 calc R U
C15_2 C 0.3664(4) 0.4962(3) 0.0754(3) 0.205(5) Uani 1 1 d D U
C16_2 C 0.3286(4) 0.4495(3) 0.0734(3) 0.209(5) Uani 1 1 d D U
C27_2 C 0.2812(3) 0.3932(2) 0.07313(15) 0.196(4) Uani 1 1 d DG U
C28_2 C 0.2905(2) 0.3477(3) 0.07329(14) 0.187(4) Uani 1 1 d DG U
O32_2 O 0.3441(3) 0.3551(4) 0.0732(2) 0.225(4) Uani 1 1 d D U
C35_2 C 0.3905(7) 0.3778(10) 0.1016(4) 0.356(11) Uani 1 1 d D U
H35A_2 H 0.4256 0.3810 0.0985 0.533 Uiso 1 1 calc R U
H35B_2 H 0.3989 0.4148 0.1096 0.533 Uiso 1 1 calc R U
H35C_2 H 0.3796 0.3537 0.1168 0.533 Uiso 1 1 calc R U
N17_2 N 0.3320(3) 0.0982(3) 0.08635(14) 0.135(2) Uani 1 1 d D U
C18_2 C 0.2751(4) 0.0806(3) 0.08215(19) 0.167(3) Uani 1 1 d D U
H18_2 H 0.2493 0.0424 0.0815 0.200 Uiso 1 1 calc R U
C19_2 C 0.2524(4) 0.1160(3) 0.0787(2) 0.194(5) Uani 1 1 d D U
H19_2 H 0.2126 0.1022 0.0769 0.233 Uiso 1 1 calc R U
C20_2 C 0.2888(4) 0.1719(3) 0.0778(2) 0.156(3) Uani 1 1 d D U
C21_2 C 0.3486(4) 0.1912(3) 0.0830(2) 0.168(3) Uani 1 1 d D U
H21_2 H 0.3751 0.2290 0.0833 0.202 Uiso 1 1 calc R U
C22_2 C 0.3682(4) 0.1530(3) 0.0879(2) 0.153(3) Uani 1 1 d D U
H22_2 H 0.4089 0.1665 0.0926 0.184 Uiso 1 1 calc R U
C23_2 C 0.2671(5) 0.2113(4) 0.0748(3) 0.190(4) Uani 1 1 d D U
C24_2 C 0.2566(4) 0.2481(4) 0.0729(3) 0.181(4) Uani 1 1 d D U
C29_2 C 0.2447(3) 0.2939(2) 0.07297(14) 0.176(4) Uani 1 1 d DG U
C30_2 C 0.1894(2) 0.2856(2) 0.07249(15) 0.209(5) Uani 1 1 d DG U
O33_2 O 0.1429(3) 0.2329(3) 0.0707(2) 0.230(4) Uani 1 1 d D U
C36_2 C 0.1319(10) 0.2158(9) 0.0977(4) 0.384(13) Uani 1 1 d D U
H36A_2 H 0.0979 0.1779 0.0924 0.576 Uiso 1 1 calc R U
H36B_2 H 0.1665 0.2166 0.1120 0.576 Uiso 1 1 calc R U
H36C_2 H 0.1236 0.2409 0.1079 0.576 Uiso 1 1 calc R U
N1_3 N 0.2338(3) 0.1074(3) 0.42687(14) 0.139(2) Uani 1 1 d D U
C2_3 C 0.2209(3) 0.0763(3) 0.39942(16) 0.154(3) Uani 1 1 d D U
H2_3 H 0.1842 0.0424 0.3917 0.185 Uiso 1 1 calc R U
C3_3 C 0.2589(3) 0.0918(3) 0.38188(17) 0.171(4) Uani 1 1 d D U
H3_3 H 0.2474 0.0697 0.3623 0.205 Uiso 1 1 calc R U
C4_3 C 0.3147(3) 0.1410(3) 0.39383(17) 0.151(3) Uani 1 1 d D U
C5_3 C 0.3275(4) 0.1738(3) 0.42196(18) 0.160(3) Uani 1 1 d D U
H5_3 H 0.3634 0.2083 0.4301 0.192 Uiso 1 1 calc R U
C6_3 C 0.2867(3) 0.1548(3) 0.43773(18) 0.160(3) Uani 1 1 d D U
H6_3 H 0.2968 0.1764 0.4572 0.192 Uiso 1 1 calc R U
C7_3 C 0.3549(4) 0.1591(4) 0.37573(19) 0.161(3) Uani 1 1 d D U
C8_3 C 0.3895(3) 0.1759(4) 0.36199(18) 0.162(3) Uani 1 1 d D U
C25_3 C 0.43226(19) 0.1984(2) 0.34524(10) 0.148(3) Uani 1 1 d DG U
C26_3 C 0.41754(18) 0.17300(19) 0.31417(10) 0.168(4) Uani 1 1 d DG U
O31_3 O 0.3624(3) 0.1253(3) 0.29962(16) 0.211(3) Uani 1 1 d D U
C34_3 C 0.3183(6) 0.1365(8) 0.2833(5) 0.347(11) Uani 1 1 d D U
H34A_3 H 0.2810 0.1014 0.2737 0.521 Uiso 1 1 calc R U
H34B_3 H 0.3134 0.1588 0.2979 0.521 Uiso 1 1 calc R U
H34C_3 H 0.3298 0.1571 0.2669 0.521 Uiso 1 1 calc R U
N9_3 N 0.3898(3) 0.0808(3) 0.14422(14) 0.145(2) Uani 1 1 d D U
C10_3 C 0.4406(4) 0.1281(3) 0.15932(16) 0.162(3) Uani 1 1 d D U
H10_3 H 0.4671 0.1462 0.1483 0.194 Uiso 1 1 calc R U
C11_3 C 0.4566(4) 0.1522(3) 0.19035(15) 0.167(4) Uani 1 1 d D U
H11_3 H 0.4924 0.1863 0.1999 0.201 Uiso 1 1 calc R U
C12_3 C 0.4182(4) 0.1248(4) 0.20709(16) 0.175(4) Uani 1 1 d D U
C13_3 C 0.3643(4) 0.0767(4) 0.19140(17) 0.181(4) Uani 1 1 d D U
H13_3 H 0.3360 0.0587 0.2015 0.217 Uiso 1 1 calc R U
C14_3 C 0.3530(4) 0.0555(4) 0.16015(17) 0.166(3) Uani 1 1 d D U
H14_3 H 0.3175 0.0216 0.1499 0.199 Uiso 1 1 calc R U
C15_3 C 0.4328(5) 0.1491(4) 0.23994(16) 0.182(4) Uani 1 1 d D U
C16_3 C 0.4452(4) 0.1693(4) 0.26630(15) 0.174(4) Uani 1 1 d D U
C27_3 C 0.4591(2) 0.1952(2) 0.29832(8) 0.162(3) Uani 1 1 d DG U
C28_3 C 0.5155(2) 0.2428(2) 0.31355(10) 0.164(3) Uani 1 1 d DG U
O32_3 O 0.5567(3) 0.2633(4) 0.29824(17) 0.218(3) Uani 1 1 d D U
C35_3 C 0.5604(9) 0.3045(8) 0.2805(5) 0.359(11) Uani 1 1 d D U
H35A_3 H 0.5916 0.3140 0.2714 0.538 Uiso 1 1 calc R U
H35B_3 H 0.5227 0.2905 0.2637 0.538 Uiso 1 1 calc R U
H35C_3 H 0.5695 0.3376 0.2939 0.538 Uiso 1 1 calc R U
N17_3 N 0.7953(3) 0.5095(3) 0.42601(14) 0.137(2) Uani 1 1 d D U
C18_3 C 0.7537(3) 0.4795(3) 0.43888(17) 0.165(3) Uani 1 1 d D U
H18_3 H 0.7608 0.4925 0.4600 0.199 Uiso 1 1 calc R U
C19_3 C 0.7011(3) 0.4309(3) 0.42297(17) 0.169(4) Uani 1 1 d D U
H19_3 H 0.6725 0.4126 0.4328 0.202 Uiso 1 1 calc R U
C20_3 C 0.6906(3) 0.4093(3) 0.39225(16) 0.149(3) Uani 1 1 d D U
C21_3 C 0.7335(4) 0.4404(4) 0.37881(19) 0.177(4) Uani 1 1 d D U
H21_3 H 0.7277 0.4280 0.3578 0.212 Uiso 1 1 calc R U
C22_3 C 0.7846(3) 0.4892(4) 0.39610(17) 0.161(3) Uani 1 1 d D U
H22_3 H 0.8133 0.5091 0.3865 0.193 Uiso 1 1 calc R U
C23_3 C 0.6349(3) 0.3594(3) 0.37379(19) 0.155(3) Uani 1 1 d D U
C24_3 C 0.5887(3) 0.3178(3) 0.3604(2) 0.156(3) Uani 1 1 d D U
C29_3 C 0.53017(17) 0.26821(18) 0.34462(10) 0.146(3) Uani 1 1 d DG U
C30_3 C 0.4886(2) 0.2460(2) 0.36046(7) 0.144(3) Uani 1 1 d DG U
O33_3 O 0.5031(3) 0.2683(3) 0.39118(10) 0.168(2) Uani 1 1 d D U
C36_3 C 0.4969(6) 0.3143(5) 0.3970(3) 0.212(5) Uani 1 1 d D U
H36A_3 H 0.5086 0.3260 0.4196 0.317 Uiso 1 1 calc R U
H36B_3 H 0.5221 0.3449 0.3884 0.317 Uiso 1 1 calc R U
H36C_3 H 0.4558 0.3039 0.3870 0.317 Uiso 1 1 calc R U
N1_4 N 0.4148(3) 0.7819(3) 0.42690(15) 0.145(2) Uani 1 1 d D U
C2_4 C 0.4610(4) 0.7750(3) 0.43992(18) 0.179(4) Uani 1 1 d D U
H2_4 H 0.4710 0.7730 0.4615 0.214 Uiso 1 1 calc R U
C3_4 C 0.4947(4) 0.7706(4) 0.42327(17) 0.179(4) Uani 1 1 d D U
H3_4 H 0.5247 0.7628 0.4330 0.214 Uiso 1 1 calc R U
C4_4 C 0.4841(4) 0.7778(4) 0.39217(17) 0.153(3) Uani 1 1 d D U
C5_4 C 0.4360(4) 0.7846(4) 0.37877(18) 0.172(4) Uani 1 1 d D U
H5_4 H 0.4248 0.7865 0.3573 0.206 Uiso 1 1 calc R U
C6_4 C 0.4044(4) 0.7884(4) 0.39696(18) 0.162(3) Uani 1 1 d D U
H6_4 H 0.3741 0.7961 0.3877 0.194 Uiso 1 1 calc R U
C7_4 C 0.5173(4) 0.7720(4) 0.3735(2) 0.167(3) Uani 1 1 d D U
C8_4 C 0.5438(4) 0.7645(4) 0.35900(18) 0.161(3) Uani 1 1 d D U
C25_4 C 0.5765(2) 0.7523(2) 0.34226(10) 0.155(3) Uani 1 1 d DG U
C26_4 C 0.6164(2) 0.7359(2) 0.35835(8) 0.157(3) Uani 1 1 d DG U
O31_4 O 0.6257(3) 0.7329(3) 0.38966(11) 0.167(2) Uani 1 1 d D U
C34_4 C 0.5871(6) 0.6818(5) 0.3962(3) 0.232(6) Uani 1 1 d D U
H34A_4 H 0.5974 0.6841 0.4189 0.348 Uiso 1 1 calc R U
H34B_4 H 0.5466 0.6736 0.3873 0.348 Uiso 1 1 calc R U
H34C_4 H 0.5907 0.6521 0.3870 0.348 Uiso 1 1 calc R U
N9_4 N 0.8230(3) 0.6243(3) 0.42506(15) 0.142(2) Uani 1 1 d D U
C10_4 C 0.8274(4) 0.6395(3) 0.39734(17) 0.174(4) Uani 1 1 d D U
H10_4 H 0.8541 0.6356 0.3896 0.209 Uiso 1 1 calc R U
C11_4 C 0.7944(4) 0.6608(4) 0.37968(18) 0.180(4) Uani 1 1 d D U
H11_4 H 0.7971 0.6690 0.3598 0.216 Uiso 1 1 calc R U
C12_4 C 0.7575(4) 0.6698(4) 0.39172(17) 0.154(3) Uani 1 1 d D U
C13_4 C 0.7529(4) 0.6533(5) 0.42024(19) 0.178(4) Uani 1 1 d D U
H13_4 H 0.7269 0.6571 0.4287 0.214 Uiso 1 1 calc R U
C14_4 C 0.7864(4) 0.6312(4) 0.43629(19) 0.167(4) Uani 1 1 d D U
H14_4 H 0.7830 0.6208 0.4557 0.201 Uiso 1 1 calc R U
C15_4 C 0.7210(5) 0.6910(5) 0.37376(19) 0.185(4) Uani 1 1 d D U
C16_4 C 0.6906(4) 0.7081(5) 0.35940(19) 0.172(4) Uani 1 1 d D U
C27_4 C 0.6482(2) 0.7240(2) 0.34258(10) 0.156(3) Uani 1 1 d DG U
C28_4 C 0.6400(2) 0.7286(2) 0.31072(10) 0.179(4) Uani 1 1 d DG U
O32_4 O 0.6736(4) 0.7204(4) 0.29539(17) 0.234(4) Uani 1 1 d D U
C35_4 C 0.6471(10) 0.6656(7) 0.2793(6) 0.404(13) Uani 1 1 d D U
H35A_4 H 0.6731 0.6631 0.2692 0.606 Uiso 1 1 calc R U
H35B_4 H 0.6402 0.6401 0.2941 0.606 Uiso 1 1 calc R U
H35C_4 H 0.6095 0.6553 0.2634 0.606 Uiso 1 1 calc R U
N17_4 N 0.5697(3) 0.7538(3) 0.13823(15) 0.158(3) Uani 1 1 d D U
C18_4 C 0.5360(4) 0.7641(4) 0.15055(17) 0.175(4) Uani 1 1 d D U
H18_4 H 0.5086 0.7722 0.1373 0.210 Uiso 1 1 calc R U
C19_4 C 0.5393(4) 0.7635(4) 0.18179(17) 0.190(4) Uani 1 1 d D U
H19_4 H 0.5142 0.7703 0.1896 0.228 Uiso 1 1 calc R U
C20_4 C 0.5808(5) 0.7525(5) 0.20143(16) 0.184(4) Uani 1 1 d D U
C21_4 C 0.6162(5) 0.7421(6) 0.18877(18) 0.204(5) Uani 1 1 d D U
H21_4 H 0.6445 0.7344 0.2015 0.245 Uiso 1 1 calc R U
C22_4 C 0.6094(4) 0.7433(5) 0.15712(18) 0.182(4) Uani 1 1 d D U
H22_4 H 0.6337 0.7364 0.1486 0.218 Uiso 1 1 calc R U
C23_4 C 0.5864(5) 0.7500(5) 0.23460(16) 0.209(5) Uani 1 1 d D U
C24_4 C 0.5921(5) 0.7489(5) 0.26153(14) 0.174(4) Uani 1 1 d D U
C29_4 C 0.6000(2) 0.7450(2) 0.29462(8) 0.170(4) Uani 1 1 d DG U
C30_4 C 0.5683(2) 0.7569(2) 0.31039(10) 0.166(3) Uani 1 1 d DG U
O33_4 O 0.5285(4) 0.7729(4) 0.29526(16) 0.220(3) Uani 1 1 d D U
C36_4 C 0.4761(6) 0.7332(7) 0.2726(4) 0.336(10) Uani 1 1 d D U
H36A_4 H 0.4525 0.7500 0.2639 0.503 Uiso 1 1 calc R U
H36B_4 H 0.4848 0.7195 0.2558 0.503 Uiso 1 1 calc R U
H36C_4 H 0.4541 0.7022 0.2820 0.503 Uiso 1 1 calc R U
C1_5 C -0.2989(3) 0.2440(3) 0.08159(16) 0.163(3) Uani 1 1 d D U
H1A_5 H -0.3013 0.2077 0.0824 0.195 Uiso 1 1 calc R U
H1B_5 H -0.3290 0.2433 0.0896 0.195 Uiso 1 1 calc R U
C2_5 C -0.3136(4) 0.2514(4) 0.04668(16) 0.165(3) Uani 1 1 d D U
H2A_5 H -0.3560 0.2254 0.0354 0.198 Uiso 1 1 calc R U
H2B_5 H -0.3060 0.2897 0.0460 0.198 Uiso 1 1 calc R U
C3_5 C -0.2775(3) 0.2409(4) 0.02949(19) 0.168(3) Uani 1 1 d D U
H3A_5 H -0.2952 0.2379 0.0068 0.201 Uiso 1 1 calc R U
H3B_5 H -0.2808 0.2048 0.0327 0.201 Uiso 1 1 calc R U
C4_5 C -0.2253(3) 0.3655(2) 0.10966(16) 0.169(3) Uani 1 1 d DG U
C5_5 C -0.1718(3) 0.4166(3) 0.1154(2) 0.212(5) Uani 1 1 d DG U
H5_5 H -0.1362 0.4169 0.1185 0.255 Uiso 1 1 calc R U
C6_5 C -0.1716(4) 0.4673(2) 0.1165(3) 0.256(7) Uani 1 1 d DG U
H6_5 H -0.1359 0.5015 0.1203 0.307 Uiso 1 1 calc R U
C7_5 C -0.2249(5) 0.4669(3) 0.1119(3) 0.273(8) Uani 1 1 d DG U
H7_5 H -0.2248 0.5009 0.1126 0.328 Uiso 1 1 calc R U
C8_5 C -0.2784(4) 0.4158(4) 0.1062(2) 0.230(6) Uani 1 1 d DG U
H8_5 H -0.3140 0.4155 0.1031 0.276 Uiso 1 1 calc R U
C9_5 C -0.2786(3) 0.3651(3) 0.1051(2) 0.205(5) Uani 1 1 d DG U
H9_5 H -0.3144 0.3309 0.1012 0.246 Uiso 1 1 calc R U
C10_5 C -0.2218(3) 0.2820(3) 0.14673(12) 0.172(3) Uani 1 1 d DG U
C11_5 C -0.2446(4) 0.2258(3) 0.15038(16) 0.196(4) Uani 1 1 d DG U
H11_5 H -0.2633 0.1971 0.1326 0.235 Uiso 1 1 calc R U
C12_5 C -0.2395(4) 0.2126(4) 0.1807(2) 0.263(6) Uani 1 1 d DG U
H12_5 H -0.2548 0.1750 0.1831 0.315 Uiso 1 1 calc R U
C13_5 C -0.2116(5) 0.2555(5) 0.20730(14) 0.260(7) Uani 1 1 d DG U
H13_5 H -0.2081 0.2467 0.2276 0.312 Uiso 1 1 calc R U
C14_5 C -0.1888(5) 0.3117(4) 0.20365(13) 0.275(8) Uani 1 1 d DG U
H14_5 H -0.1701 0.3405 0.2215 0.330 Uiso 1 1 calc R U
C15_5 C -0.1939(4) 0.3250(3) 0.17337(17) 0.220(5) Uani 1 1 d DG U
H15_5 H -0.1787 0.3626 0.1709 0.264 Uiso 1 1 calc R U
C16_5 C -0.1938(4) 0.3599(3) 0.0306(2) 0.246(3) Uani 1 1 d DG U
C17_5 C -0.1468(4) 0.4124(3) 0.04869(19) 0.246(3) Uani 1 1 d DG U
H17_5 H -0.1174 0.4143 0.0666 0.295 Uiso 1 1 calc R U
C18_5 C -0.1436(4) 0.4619(3) 0.0401(2) 0.246(3) Uani 1 1 d DG U
H18_5 H -0.1121 0.4970 0.0523 0.295 Uiso 1 1 calc R U
C19_5 C -0.1874(5) 0.4591(3) 0.0134(2) 0.246(3) Uani 1 1 d DG U
H19_5 H -0.1853 0.4922 0.0077 0.295 Uiso 1 1 calc R U
C20_5 C -0.2345(4) 0.4067(4) -0.0047(2) 0.246(3) Uani 1 1 d DG U
H20_5 H -0.2638 0.4048 -0.0226 0.295 Uiso 1 1 calc R U
C21_5 C -0.2377(4) 0.3571(3) 0.0039(2) 0.246(3) Uani 1 1 d DG U
H21_5 H -0.2692 0.3220 -0.0083 0.295 Uiso 1 1 calc R U
C22_5 C -0.1702(4) 0.2752(3) 0.01505(18) 0.245(3) Uani 1 1 d DG U
C23_5 C -0.1824(4) 0.2197(3) 0.0102(2) 0.245(3) Uani 1 1 d DG U
H23_5 H -0.2059 0.1933 0.0203 0.294 Uiso 1 1 calc R U
C24_5 C -0.1594(4) 0.2038(3) -0.0099(2) 0.245(3) Uani 1 1 d DG U
H24_5 H -0.1675 0.1667 -0.0132 0.294 Uiso 1 1 calc R U
C25_5 C -0.1242(4) 0.2433(4) -0.02510(19) 0.245(3) Uani 1 1 d DG U
H25_5 H -0.1088 0.2326 -0.0385 0.294 Uiso 1 1 calc R U
C26_5 C -0.1120(4) 0.2987(4) -0.0202(2) 0.245(3) Uani 1 1 d DG U
H26_5 H -0.0885 0.3252 -0.0304 0.294 Uiso 1 1 calc R U
C27_5 C -0.1350(4) 0.3147(3) -0.0002(2) 0.245(3) Uani 1 1 d DG U
H27_5 H -0.1268 0.3518 0.0031 0.294 Uiso 1 1 calc R U
P1_5 P -0.22509(11) 0.29940(12) 0.10769(6) 0.1517(8) Uani 1 1 d D U
P2_5 P -0.19816(11) 0.29519(12) 0.04208(6) 0.1533(8) Uani 1 1 d D U
C1_6 C 0.1444(3) -0.0434(3) 0.4755(2) 0.151(3) Uani 1 1 d D U
H1A_6 H 0.1197 -0.0622 0.4535 0.182 Uiso 1 1 calc R U
H1B_6 H 0.1615 -0.0657 0.4848 0.182 Uiso 1 1 calc R U
C2_6 C 0.1037(4) -0.0433(4) 0.4935(2) 0.164(3) Uani 1 1 d D U
H2A_6 H 0.0775 -0.0819 0.4954 0.196 Uiso 1 1 calc R U
H2B_6 H 0.1285 -0.0214 0.5150 0.196 Uiso 1 1 calc R U
C3_6 C 0.0652(3) -0.0187(2) 0.4775(2) 0.151(3) Uani 1 1 d D U
H3A_6 H 0.0360 -0.0262 0.4880 0.181 Uiso 1 1 calc R U
H3B_6 H 0.0432 -0.0386 0.4555 0.181 Uiso 1 1 calc R U
C4_6 C 0.2559(2) 0.0568(3) 0.51601(10) 0.147(3) Uani 1 1 d DG U
C5_6 C 0.2895(3) 0.1155(3) 0.52555(14) 0.170(3) Uani 1 1 d DG U
H5_6 H 0.2857 0.1384 0.5111 0.204 Uiso 1 1 calc R U
C6_6 C 0.3287(3) 0.1398(2) 0.55669(16) 0.194(4) Uani 1 1 d DG U
H6_6 H 0.3512 0.1791 0.5631 0.233 Uiso 1 1 calc R U
C7_6 C 0.3343(3) 0.1055(4) 0.57829(11) 0.195(4) Uani 1 1 d DG U
H7_6 H 0.3606 0.1218 0.5991 0.234 Uiso 1 1 calc R U
C8_6 C 0.3007(4) 0.0468(3) 0.56876(14) 0.195(4) Uani 1 1 d DG U
H8_6 H 0.3045 0.0239 0.5832 0.234 Uiso 1 1 calc R U
C9_6 C 0.2615(3) 0.0225(2) 0.53762(15) 0.180(4) Uani 1 1 d DG U
H9_6 H 0.2390 -0.0168 0.5312 0.216 Uiso 1 1 calc R U
C10_6 C 0.2474(3) 0.0111(3) 0.45524(14) 0.154(3) Uani 1 1 d DG U
C11_6 C 0.2181(3) -0.0357(3) 0.43068(17) 0.210(5) Uani 1 1 d DG U
H11_6 H 0.1767 -0.0595 0.4245 0.252 Uiso 1 1 calc R U
C12_6 C 0.2509(4) -0.0469(3) 0.41540(17) 0.207(5) Uani 1 1 d DG U
H12_6 H 0.2313 -0.0782 0.3990 0.248 Uiso 1 1 calc R U
C13_6 C 0.3128(4) -0.0114(4) 0.42468(18) 0.191(4) Uani 1 1 d DG U
H13_6 H 0.3347 -0.0189 0.4145 0.230 Uiso 1 1 calc R U
C14_6 C 0.3421(2) 0.0354(4) 0.44923(19) 0.212(5) Uani 1 1 d DG U
H14_6 H 0.3835 0.0592 0.4554 0.254 Uiso 1 1 calc R U
C15_6 C 0.3093(3) 0.0466(3) 0.46451(15) 0.172(4) Uani 1 1 d DG U
H15_6 H 0.3289 0.0779 0.4809 0.206 Uiso 1 1 calc R U
C16_6 C 0.1385(3) 0.0936(2) 0.51871(9) 0.149(3) Uani 1 1 d DG U
C17_6 C 0.1889(3) 0.1478(3) 0.52733(13) 0.157(3) Uani 1 1 d DG U
H17_6 H 0.2049 0.1653 0.5119 0.189 Uiso 1 1 calc R U
C18_6 C 0.2155(3) 0.1759(2) 0.55894(15) 0.183(4) Uani 1 1 d DG U
H18_6 H 0.2492 0.2122 0.5647 0.220 Uiso 1 1 calc R U
C19_6 C 0.1916(3) 0.1498(3) 0.58193(10) 0.190(4) Uani 1 1 d DG U
H19_6 H 0.2094 0.1686 0.6031 0.227 Uiso 1 1 calc R U
C20_6 C 0.1412(3) 0.0956(3) 0.57331(12) 0.193(4) Uani 1 1 d DG U
H20_6 H 0.1253 0.0781 0.5887 0.231 Uiso 1 1 calc R U
C21_6 C 0.1147(3) 0.0674(2) 0.54170(14) 0.158(3) Uani 1 1 d DG U
H21_6 H 0.0809 0.0311 0.5359 0.190 Uiso 1 1 calc R U
C22_6 C 0.0469(2) 0.0721(3) 0.45988(15) 0.148(3) Uani 1 1 d DG U
C23_6 C 0.0050(3) 0.0408(3) 0.43011(15) 0.168(3) Uani 1 1 d DG U
H23_6 H 0.0072 0.0124 0.4199 0.201 Uiso 1 1 calc R U
C24_6 C -0.0401(3) 0.0521(3) 0.41566(15) 0.190(4) Uani 1 1 d DG U
H24_6 H -0.0682 0.0313 0.3957 0.228 Uiso 1 1 calc R U
C25_6 C -0.0434(3) 0.0947(4) 0.4310(2) 0.207(5) Uani 1 1 d DG U
H25_6 H -0.0737 0.1022 0.4213 0.248 Uiso 1 1 calc R U
C26_6 C -0.0015(4) 0.1259(3) 0.4608(2) 0.221(5) Uani 1 1 d DG U
H26_6 H -0.0037 0.1543 0.4710 0.265 Uiso 1 1 calc R U
C27_6 C 0.0436(3) 0.1146(3) 0.47521(14) 0.186(4) Uani 1 1 d DG U
H27_6 H 0.0717 0.1355 0.4951 0.223 Uiso 1 1 calc R U
P1_6 P 0.20510(11) 0.02571(10) 0.47539(5) 0.1394(7) Uani 1 1 d D U
P2_6 P 0.10608(11) 0.05706(10) 0.47772(5) 0.1402(7) Uani 1 1 d D U
C1_7 C 0.2826(4) 0.8319(3) 0.4758(2) 0.155(3) Uani 1 1 d D U
H1A_7 H 0.2680 0.8350 0.4538 0.186 Uiso 1 1 calc R U
H1B_7 H 0.2517 0.8245 0.4850 0.186 Uiso 1 1 calc R U
C2_7 C 0.3386(3) 0.8890(3) 0.4937(2) 0.158(3) Uani 1 1 d D U
H2A_7 H 0.3267 0.9167 0.4959 0.189 Uiso 1 1 calc R U
H2B_7 H 0.3564 0.8849 0.5150 0.189 Uiso 1 1 calc R U
C3_7 C 0.3856(3) 0.9111(3) 0.4771(2) 0.149(3) Uani 1 1 d D U
H3A_7 H 0.4159 0.9500 0.4874 0.179 Uiso 1 1 calc R U
H3B_7 H 0.3664 0.9112 0.4552 0.179 Uiso 1 1 calc R U
C4_7 C 0.3136(3) 0.7618(3) 0.51683(10) 0.146(3) Uani 1 1 d DG U
C5_7 C 0.3485(3) 0.7372(3) 0.52649(14) 0.167(3) Uani 1 1 d DG U
H5_7 H 0.3628 0.7271 0.5122 0.200 Uiso 1 1 calc R U
C6_7 C 0.3621(3) 0.7278(3) 0.55753(16) 0.185(4) Uani 1 1 d DG U
H6_7 H 0.3854 0.7113 0.5640 0.222 Uiso 1 1 calc R U
C7_7 C 0.3408(4) 0.7429(3) 0.57891(11) 0.200(4) Uani 1 1 d DG U
H7_7 H 0.3498 0.7366 0.5997 0.240 Uiso 1 1 calc R U
C8_7 C 0.3059(4) 0.7675(3) 0.56925(13) 0.201(4) Uani 1 1 d DG U
H8_7 H 0.2916 0.7777 0.5836 0.241 Uiso 1 1 calc R U
C9_7 C 0.2923(3) 0.7770(3) 0.53821(15) 0.182(4) Uani 1 1 d DG U
H9_7 H 0.2690 0.7935 0.5317 0.218 Uiso 1 1 calc R U
C10_7 C 0.2192(2) 0.7111(2) 0.45641(14) 0.149(3) Uani 1 1 d DG U
C11_7 C 0.1767(3) 0.7164(3) 0.43282(17) 0.189(4) Uani 1 1 d DG U
H11_7 H 0.1861 0.7516 0.4273 0.227 Uiso 1 1 calc R U
C12_7 C 0.1202(3) 0.6691(4) 0.41746(17) 0.230(6) Uani 1 1 d DG U
H12_7 H 0.0917 0.6727 0.4017 0.276 Uiso 1 1 calc R U
C13_7 C 0.1062(2) 0.6166(3) 0.42570(17) 0.196(4) Uani 1 1 d DG U
H13_7 H 0.0684 0.5850 0.4154 0.235 Uiso 1 1 calc R U
C14_7 C 0.1487(3) 0.6113(2) 0.44930(18) 0.200(4) Uani 1 1 d DG U
H14_7 H 0.1393 0.5761 0.4548 0.240 Uiso 1 1 calc R U
C15_7 C 0.2052(3) 0.6585(3) 0.46465(14) 0.178(4) Uani 1 1 d DG U
H15_7 H 0.2337 0.6550 0.4804 0.213 Uiso 1 1 calc R U
C16_7 C 0.4650(2) 0.8773(2) 0.51838(9) 0.136(2) Uani 1 1 d DG U
C17_7 C 0.4784(3) 0.8355(2) 0.52656(12) 0.155(3) Uani 1 1 d DG U
H17_7 H 0.4654 0.8045 0.5111 0.186 Uiso 1 1 calc R U
C18_7 C 0.5114(3) 0.8400(3) 0.55784(14) 0.167(3) Uani 1 1 d DG U
H18_7 H 0.5204 0.8120 0.5633 0.201 Uiso 1 1 calc R U
C19_7 C 0.5309(3) 0.8863(3) 0.58092(10) 0.189(4) Uani 1 1 d DG U
H19_7 H 0.5530 0.8893 0.6018 0.227 Uiso 1 1 calc R U
C20_7 C 0.5175(3) 0.9281(3) 0.57273(11) 0.180(4) Uani 1 1 d DG U
H20_7 H 0.5305 0.9591 0.5882 0.216 Uiso 1 1 calc R U
C21_7 C 0.4845(3) 0.9236(2) 0.54146(13) 0.160(3) Uani 1 1 d DG U
H21_7 H 0.4755 0.9516 0.5360 0.192 Uiso 1 1 calc R U
C22_7 C 0.4790(3) 0.9107(2) 0.45929(15) 0.144(3) Uani 1 1 d DG U
C23_7 C 0.4610(3) 0.9212(3) 0.42887(15) 0.165(3) Uani 1 1 d DG U
H23_7 H 0.4208 0.9090 0.4185 0.198 Uiso 1 1 calc R U
C24_7 C 0.5032(4) 0.9498(3) 0.41401(14) 0.199(4) Uani 1 1 d DG U
H24_7 H 0.4911 0.9568 0.3937 0.239 Uiso 1 1 calc R U
C25_7 C 0.5633(4) 0.9680(3) 0.4296(2) 0.206(5) Uani 1 1 d DG U
H25_7 H 0.5915 0.9872 0.4196 0.247 Uiso 1 1 calc R U
C26_7 C 0.5813(2) 0.9576(3) 0.4600(2) 0.212(5) Uani 1 1 d DG U
H26_7 H 0.6216 0.9698 0.4704 0.255 Uiso 1 1 calc R U
C27_7 C 0.5392(3) 0.9289(3) 0.47485(14) 0.183(4) Uani 1 1 d DG U
H27_7 H 0.5512 0.9219 0.4952 0.219 Uiso 1 1 calc R U
P1_7 P 0.29307(11) 0.77192(10) 0.47606(5) 0.1405(7) Uani 1 1 d D U
P2_7 P 0.42279(11) 0.87071(10) 0.47730(5) 0.1382(7) Uani 1 1 d D U
C1_8 C 0.3057(4) -0.0657(2) 0.0369(2) 0.161(3) Uani 1 1 d D U
H1A_8 H 0.2728 -0.0820 0.0453 0.193 Uiso 1 1 calc R U
H1B_8 H 0.2891 -0.0795 0.0140 0.193 Uiso 1 1 calc R U
C2_8 C 0.3500(5) -0.0858(4) 0.05198(17) 0.173(3) Uani 1 1 d D U
H2A_8 H 0.3328 -0.1251 0.0423 0.208 Uiso 1 1 calc R U
H2B_8 H 0.3871 -0.0632 0.0476 0.208 Uiso 1 1 calc R U
C3_8 C 0.3638(4) -0.0808(3) 0.08816(17) 0.176(3) Uani 1 1 d D U
H3A_8 H 0.3852 -0.1005 0.0958 0.211 Uiso 1 1 calc R U
H3B_8 H 0.3261 -0.1000 0.0924 0.211 Uiso 1 1 calc R U
C4_8 C 0.4010(2) 0.0378(2) 0.02804(13) 0.140(2) Uani 1 1 d DG U
C5_8 C 0.4525(3) 0.0905(2) 0.04200(12) 0.161(3) Uani 1 1 d DG U
H5_8 H 0.4556 0.1120 0.0597 0.193 Uiso 1 1 calc R U
C6_8 C 0.4991(2) 0.1111(3) 0.02955(16) 0.178(4) Uani 1 1 d DG U
H6_8 H 0.5335 0.1464 0.0389 0.214 Uiso 1 1 calc R U
C7_8 C 0.4944(3) 0.0790(3) 0.00313(16) 0.188(4) Uani 1 1 d DG U
H7_8 H 0.5256 0.0928 -0.0052 0.225 Uiso 1 1 calc R U
C8_8 C 0.4430(3) 0.0263(3) -0.01083(13) 0.185(4) Uani 1 1 d DG U
H8_8 H 0.4398 0.0048 -0.0285 0.222 Uiso 1 1 calc R U
C9_8 C 0.3963(3) 0.0057(2) 0.00162(13) 0.175(4) Uani 1 1 d DG U
H9_8 H 0.3619 -0.0295 -0.0077 0.210 Uiso 1 1 calc R U
C10_8 C 0.2861(3) 0.0258(3) 0.02027(14) 0.162(3) Uani 1 1 d DG U
C11_8 C 0.2250(3) -0.0122(3) 0.0131(2) 0.222(5) Uani 1 1 d DG U
H11_8 H 0.2120 -0.0469 0.0197 0.267 Uiso 1 1 calc R U
C12_8 C 0.1833(3) 0.0016(4) -0.0040(2) 0.262(7) Uani 1 1 d DG U
H12_8 H 0.1425 -0.0239 -0.0088 0.314 Uiso 1 1 calc R U
C13_8 C 0.2028(4) 0.0534(5) -0.0139(2) 0.274(8) Uani 1 1 d DG U
H13_8 H 0.1749 0.0626 -0.0254 0.328 Uiso 1 1 calc R U
C14_8 C 0.2638(5) 0.0915(4) -0.0068(2) 0.225(5) Uani 1 1 d DG U
H14_8 H 0.2768 0.1262 -0.0134 0.271 Uiso 1 1 calc R U
C15_8 C 0.3055(3) 0.0777(3) 0.01034(18) 0.193(4) Uani 1 1 d DG U
H15_8 H 0.3464 0.1032 0.0151 0.231 Uiso 1 1 calc R U
C16_8 C 0.4828(2) 0.0217(3) 0.10787(14) 0.156(3) Uani 1 1 d DG U
C17_8 C 0.5196(3) 0.0804(3) 0.11398(17) 0.168(3) Uani 1 1 d DG U
H17_8 H 0.5053 0.1033 0.1188 0.201 Uiso 1 1 calc R U
C18_8 C 0.5776(3) 0.1048(3) 0.1129(2) 0.200(4) Uani 1 1 d DG U
H18_8 H 0.6022 0.1440 0.1170 0.240 Uiso 1 1 calc R U
C19_8 C 0.5989(2) 0.0705(4) 0.1058(2) 0.217(5) Uani 1 1 d DG U
H19_8 H 0.6377 0.0868 0.1051 0.260 Uiso 1 1 calc R U
C20_8 C 0.5621(4) 0.0118(4) 0.0997(2) 0.210(5) Uani 1 1 d DG U
H20_8 H 0.5764 -0.0112 0.0949 0.252 Uiso 1 1 calc R U
C21_8 C 0.5041(3) -0.0126(2) 0.10071(18) 0.190(4) Uani 1 1 d DG U
H21_8 H 0.4795 -0.0519 0.0966 0.228 Uiso 1 1 calc R U
C22_8 C 0.4159(4) -0.0187(3) 0.15170(12) 0.176(3) Uani 1 1 d DG U
C23_8 C 0.3650(3) -0.0559(4) 0.15880(18) 0.219(5) Uani 1 1 d DG U
H23_8 H 0.3283 -0.0773 0.1425 0.263 Uiso 1 1 calc R U
C24_8 C 0.3690(5) -0.0611(5) 0.1903(2) 0.293(8) Uani 1 1 d DG U
H24_8 H 0.3349 -0.0860 0.1950 0.352 Uiso 1 1 calc R U
C25_8 C 0.4238(6) -0.0292(5) 0.21465(14) 0.317(9) Uani 1 1 d DG U
H25_8 H 0.4265 -0.0326 0.2357 0.381 Uiso 1 1 calc R U
C26_8 C 0.4748(5) 0.0080(5) 0.20755(15) 0.318(10) Uani 1 1 d DG U
H26_8 H 0.5115 0.0294 0.2239 0.382 Uiso 1 1 calc R U
C27_8 C 0.4708(3) 0.0132(4) 0.17607(18) 0.236(6) Uani 1 1 d DG U
H27_8 H 0.5049 0.0381 0.1713 0.283 Uiso 1 1 calc R U
P1_8 P 0.34074(11) 0.01091(10) 0.04462(5) 0.1395(7) Uani 1 1 d D U
P2_8 P 0.40798(13) -0.00882(11) 0.11077(5) 0.1486(8) Uani 1 1 d D U
C1_9 C 0.6010(5) 0.8803(4) 0.06962(16) 0.184(4) Uani 1 1 d D U
H1A_9 H 0.5614 0.8729 0.0682 0.221 Uiso 1 1 calc R U
H1B_9 H 0.6287 0.9209 0.0761 0.221 Uiso 1 1 calc R U
C2_9 C 0.5992(5) 0.8606(4) 0.03654(18) 0.190(4) Uani 1 1 d D U
H2A_9 H 0.6003 0.8884 0.0233 0.228 Uiso 1 1 calc R U
H2B_9 H 0.6343 0.8574 0.0387 0.228 Uiso 1 1 calc R U
C3_9 C 0.5421(4) 0.8030(3) 0.0206(2) 0.184(4) Uani 1 1 d D U
H3A_9 H 0.5359 0.7967 -0.0021 0.220 Uiso 1 1 calc R U
H3B_9 H 0.5080 0.8041 0.0229 0.220 Uiso 1 1 calc R U
C4_9 C 0.6998(3) 0.8639(4) 0.1030(2) 0.277(3) Uani 1 1 d DG U
C5_9 C 0.7192(4) 0.8255(4) 0.1094(3) 0.277(3) Uani 1 1 d DG U
H5_9 H 0.6931 0.7895 0.1120 0.332 Uiso 1 1 calc R U
C6_9 C 0.7776(4) 0.8410(5) 0.1118(3) 0.277(3) Uani 1 1 d DG U
H6_9 H 0.7906 0.8153 0.1161 0.332 Uiso 1 1 calc R U
C7_9 C 0.8166(3) 0.8948(5) 0.1079(3) 0.277(3) Uani 1 1 d DG U
H7_9 H 0.8557 0.9052 0.1095 0.332 Uiso 1 1 calc R U
C8_9 C 0.7972(4) 0.9332(4) 0.1015(3) 0.277(3) Uani 1 1 d DG U
H8_9 H 0.8233 0.9693 0.0988 0.332 Uiso 1 1 calc R U
C9_9 C 0.7388(4) 0.9178(4) 0.0990(3) 0.277(3) Uani 1 1 d DG U
H9_9 H 0.7259 0.9435 0.0947 0.332 Uiso 1 1 calc R U
C10_9 C 0.6291(4) 0.8806(4) 0.13592(14) 0.278(3) Uani 1 1 d DG U
C11_9 C 0.5864(4) 0.8952(4) 0.13568(16) 0.278(3) Uani 1 1 d DG U
H11_9 H 0.5568 0.8887 0.1166 0.333 Uiso 1 1 calc R U
C12_9 C 0.5880(5) 0.9195(5) 0.1640(2) 0.278(3) Uani 1 1 d DG U
H12_9 H 0.5594 0.9293 0.1638 0.333 Uiso 1 1 calc R U
C13_9 C 0.6323(5) 0.9292(4) 0.19248(16) 0.278(3) Uani 1 1 d DG U
H13_9 H 0.6333 0.9455 0.2114 0.333 Uiso 1 1 calc R U
C14_9 C 0.6750(5) 0.9146(5) 0.19273(14) 0.278(3) Uani 1 1 d DG U
H14_9 H 0.7046 0.9211 0.2118 0.333 Uiso 1 1 calc R U
C15_9 C 0.6734(4) 0.8903(5) 0.16445(19) 0.278(3) Uani 1 1 d DG U
H15_9 H 0.7020 0.8806 0.1646 0.333 Uiso 1 1 calc R U
C16_9 C 0.5996(3) 0.7360(4) 0.0255(2) 0.251(3) Uani 1 1 d DG U
C17_9 C 0.6371(4) 0.7221(4) 0.04697(18) 0.251(3) Uani 1 1 d DG U
H17_9 H 0.6345 0.7183 0.0673 0.302 Uiso 1 1 calc R U
C18_9 C 0.6783(4) 0.7140(5) 0.0381(2) 0.251(3) Uani 1 1 d DG U
H18_9 H 0.7034 0.7047 0.0525 0.302 Uiso 1 1 calc R U
C19_9 C 0.6820(4) 0.7197(4) 0.0077(2) 0.251(3) Uani 1 1 d DG U
H19_9 H 0.7096 0.7143 0.0018 0.302 Uiso 1 1 calc R U
C20_9 C 0.6446(5) 0.7336(5) -0.01378(19) 0.251(3) Uani 1 1 d DG U
H20_9 H 0.6471 0.7375 -0.0341 0.302 Uiso 1 1 calc R U
C21_9 C 0.6033(4) 0.7418(4) -0.00490(19) 0.251(3) Uani 1 1 d DG U
H21_9 H 0.5782 0.7511 -0.0193 0.302 Uiso 1 1 calc R U
C22_9 C 0.4742(3) 0.6820(3) 0.01378(15) 0.171(3) Uani 1 1 d DG U
C23_9 C 0.4226(4) 0.6851(3) 0.0021(2) 0.206(5) Uani 1 1 d DG U
H23_9 H 0.4243 0.7195 0.0059 0.247 Uiso 1 1 calc R U
C24_9 C 0.3683(3) 0.6370(5) -0.0154(2) 0.262(7) Uani 1 1 d DG U
H24_9 H 0.3338 0.6391 -0.0232 0.315 Uiso 1 1 calc R U
C25_9 C 0.3657(3) 0.5856(3) -0.0211(2) 0.268(7) Uani 1 1 d DG U
H25_9 H 0.3294 0.5534 -0.0328 0.321 Uiso 1 1 calc R U
C26_9 C 0.4173(5) 0.5824(3) -0.0094(2) 0.257(7) Uani 1 1 d DG U
H26_9 H 0.4155 0.5481 -0.0132 0.309 Uiso 1 1 calc R U
C27_9 C 0.4715(4) 0.6306(3) 0.0080(2) 0.219(5) Uani 1 1 d DG U
H27_9 H 0.5061 0.6285 0.0159 0.263 Uiso 1 1 calc R U
P1_9 P 0.62404(15) 0.84522(14) 0.09965(6) 0.1857(11) Uani 1 1 d D U
P2_9 P 0.54458(14) 0.74417(13) 0.03687(6) 0.1632(9) Uani 1 1 d D U
C1_10 C 1.0231(3) 0.6847(3) 0.47403(19) 0.144(3) Uani 1 1 d D U
H1A_10 H 1.0216 0.6784 0.4522 0.173 Uiso 1 1 calc R U
H1B_10 H 1.0547 0.7235 0.4838 0.173 Uiso 1 1 calc R U
C2_10 C 1.0393(3) 0.6446(3) 0.4918(2) 0.158(3) Uani 1 1 d D U
H2A_10 H 1.0374 0.6486 0.5131 0.189 Uiso 1 1 calc R U
H2B_10 H 1.0805 0.6564 0.4940 0.189 Uiso 1 1 calc R U
C3_10 C 0.9990(3) 0.5818(3) 0.4758(2) 0.160(3) Uani 1 1 d D U
H3A_10 H 1.0172 0.5611 0.4864 0.192 Uiso 1 1 calc R U
H3B_10 H 0.9978 0.5784 0.4538 0.192 Uiso 1 1 calc R U
C4_10 C 0.9587(3) 0.6970(3) 0.51444(10) 0.147(3) Uani 1 1 d DG U
C5_10 C 0.9077(3) 0.6735(3) 0.52344(14) 0.169(3) Uani 1 1 d DG U
H5_10 H 0.8704 0.6480 0.5085 0.203 Uiso 1 1 calc R U
C6_10 C 0.9126(3) 0.6882(3) 0.55470(16) 0.209(5) Uani 1 1 d DG U
H6_10 H 0.8785 0.6724 0.5607 0.251 Uiso 1 1 calc R U
C7_10 C 0.9684(4) 0.7263(4) 0.57697(11) 0.197(4) Uani 1 1 d DG U
H7_10 H 0.9717 0.7361 0.5979 0.237 Uiso 1 1 calc R U
C8_10 C 1.0194(3) 0.7499(3) 0.56797(14) 0.217(5) Uani 1 1 d DG U
H8_10 H 1.0567 0.7754 0.5829 0.260 Uiso 1 1 calc R U
C9_10 C 1.0145(3) 0.7352(3) 0.53671(15) 0.191(4) Uani 1 1 d DG U
H9_10 H 1.0486 0.7510 0.5307 0.229 Uiso 1 1 calc R U
C10_10 C 0.9477(4) 0.7322(3) 0.45416(17) 0.218(2) Uani 1 1 d DG U
C11_10 C 0.9701(4) 0.7474(3) 0.42917(19) 0.218(2) Uani 1 1 d DG U
H11_10 H 0.9881 0.7295 0.4227 0.262 Uiso 1 1 calc R U
C12_10 C 0.9656(4) 0.7893(4) 0.41383(17) 0.218(2) Uani 1 1 d DG U
H12_10 H 0.9806 0.7995 0.3971 0.262 Uiso 1 1 calc R U
C13_10 C 0.9386(4) 0.8161(3) 0.42347(19) 0.218(2) Uani 1 1 d DG U
H13_10 H 0.9356 0.8441 0.4132 0.262 Uiso 1 1 calc R U
C14_10 C 0.9162(4) 0.8009(3) 0.4485(2) 0.218(2) Uani 1 1 d DG U
H14_10 H 0.8982 0.8188 0.4549 0.262 Uiso 1 1 calc R U
C15_10 C 0.9207(4) 0.7589(3) 0.46381(17) 0.218(2) Uani 1 1 d DG U
H15_10 H 0.9057 0.7488 0.4805 0.262 Uiso 1 1 calc R U
C16_10 C 0.9245(3) 0.5476(2) 0.51717(9) 0.134(2) Uani 1 1 d DG U
C17_10 C 0.8760(2) 0.5428(3) 0.52478(12) 0.161(3) Uani 1 1 d DG U
H17_10 H 0.8435 0.5405 0.5090 0.193 Uiso 1 1 calc R U
C18_10 C 0.8761(3) 0.5416(3) 0.55603(14) 0.174(4) Uani 1 1 d DG U
H18_10 H 0.8437 0.5384 0.5611 0.208 Uiso 1 1 calc R U
C19_10 C 0.9247(3) 0.5451(3) 0.57965(9) 0.172(4) Uani 1 1 d DG U
H19_10 H 0.9248 0.5443 0.6006 0.207 Uiso 1 1 calc R U
C20_10 C 0.9732(3) 0.5499(3) 0.57204(11) 0.174(4) Uani 1 1 d DG U
H20_10 H 1.0057 0.5523 0.5878 0.209 Uiso 1 1 calc R U
C21_10 C 0.9731(2) 0.5512(3) 0.54079(13) 0.155(3) Uani 1 1 d DG U
H21_10 H 1.0056 0.5544 0.5357 0.185 Uiso 1 1 calc R U
C22_10 C 0.8887(2) 0.4750(2) 0.45773(14) 0.143(3) Uani 1 1 d DG U
C23_10 C 0.8931(3) 0.4631(3) 0.42836(14) 0.178(4) Uani 1 1 d DG U
H23_10 H 0.9125 0.4925 0.4183 0.213 Uiso 1 1 calc R U
C24_10 C 0.8685(4) 0.4072(3) 0.41398(14) 0.201(4) Uani 1 1 d DG U
H24_10 H 0.8715 0.3992 0.3943 0.242 Uiso 1 1 calc R U
C25_10 C 0.8396(3) 0.3631(2) 0.4290(2) 0.203(5) Uani 1 1 d DG U
H25_10 H 0.8231 0.3257 0.4194 0.243 Uiso 1 1 calc R U
C26_10 C 0.8352(3) 0.3750(2) 0.4584(2) 0.204(5) Uani 1 1 d DG U
H26_10 H 0.8158 0.3456 0.4684 0.245 Uiso 1 1 calc R U
C27_10 C 0.8598(3) 0.4309(3) 0.47273(14) 0.178(4) Uani 1 1 d DG U
H27_10 H 0.8568 0.4389 0.4924 0.214 Uiso 1 1 calc R U
P1_10 P 0.95207(11) 0.67609(11) 0.47374(5) 0.1418(7) Uani 1 1 d D U
P2_10 P 0.92202(10) 0.54840(10) 0.47615(5) 0.1353(7) Uani 1 1 d D U
C1_11 C 0.5433(2) 0.30915(13) 0.09933(12) 0.246(5) Uani 1 1 d G U
F1_11 F 0.5919(3) 0.33672(18) 0.12546(14) 0.310(5) Uani 1 1 d G U
F2_11 F 0.4975(3) 0.3081(2) 0.10571(17) 0.317(5) Uani 1 1 d G U
F3_11 F 0.5537(3) 0.33924(16) 0.07646(17) 0.307(4) Uani 1 1 d G U
O1_11 O 0.47785(19) 0.21653(19) 0.05702(9) 0.212(3) Uani 1 1 d G U
O2_11 O 0.58328(18) 0.24926(19) 0.08303(14) 0.243(4) Uani 1 1 d G U
O3_11 O 0.5143(2) 0.21019(18) 0.11269(10) 0.218(3) Uani 1 1 d G U
S1_11 S 0.52733(14) 0.23792(11) 0.08677(7) 0.1878(11) Uani 1 1 d G U
C1_12 C 0.7936(3) 0.1384(3) 0.43146(9) 0.313(7) Uani 1 1 d G U
F1_12 F 0.8345(4) 0.1730(4) 0.41894(13) 0.369(6) Uani 1 1 d G U
F2_12 F 0.7448(3) 0.1422(4) 0.41980(13) 0.392(7) Uani 1 1 d G U
F3_12 F 0.7790(4) 0.0856(3) 0.42137(14) 0.380(7) Uani 1 1 d G U
O1_12 O 0.7759(3) 0.1117(2) 0.48438(14) 0.267(4) Uani 1 1 d G U
O2_12 O 0.8765(2) 0.1522(3) 0.48194(14) 0.290(5) Uani 1 1 d G U
O3_12 O 0.8336(3) 0.21187(19) 0.48213(14) 0.272(5) Uani 1 1 d G U
S1_12 S 0.82288(17) 0.15589(17) 0.47490(9) 0.2252(15) Uani 1 1 d G U
C1_13 C 0.3560(2) 0.7610(3) 0.07928(16) 0.330(8) Uani 1 1 d G U
F1_13 F 0.3120(2) 0.7709(4) 0.0652(2) 0.429(8) Uani 1 1 d G U
F2_13 F 0.3727(4) 0.7772(5) 0.11065(17) 0.468(9) Uani 1 1 d G U
F3_13 F 0.3333(3) 0.7052(3) 0.0731(3) 0.410(7) Uani 1 1 d G U
O1_13 O 0.4592(2) 0.7782(3) 0.07976(16) 0.255(4) Uani 1 1 d G U
O2_13 O 0.3901(3) 0.7762(3) 0.03058(8) 0.321(6) Uani 1 1 d G U
O3_13 O 0.4402(3) 0.85635(15) 0.07421(18) 0.314(6) Uani 1 1 d G U
S1_13 S 0.41888(15) 0.79763(15) 0.06462(8) 0.1916(11) Uani 1 1 d G U
C1_14 C -0.2498(4) 0.0573(2) 0.0881(2) 0.432(10) Uani 1 1 d G U
F1_14 F -0.2902(6) 0.01166(17) 0.0653(3) 0.503(10) Uani 1 1 d G U
F2_14 F -0.2663(7) 0.0497(5) 0.1139(3) 0.573(12) Uani 1 1 d G U
F3_14 F -0.1973(5) 0.0597(5) 0.0952(3) 0.455(9) Uani 1 1 d G U
O1_14 O -0.1948(4) 0.1668(2) 0.10095(19) 0.383(8) Uani 1 1 d G U
O2_14 O -0.2290(5) 0.1196(4) 0.04628(17) 0.508(12) Uani 1 1 d G U
O3_14 O -0.3016(3) 0.1145(4) 0.0699(3) 0.503(12) Uani 1 1 d G U
S1_14 S -0.24355(19) 0.12188(16) 0.07502(10) 0.2243(15) Uani 1 1 d G U
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0070 0.0030 '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 0.0330 0.0200 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0130 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0220 0.0120 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1670 0.1760 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -7.5810 8.5740 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1940 0.2240 '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
N1_2 Pt1 N1_1 86.1(2)
N1_2 Pt1 P1_5 177.0(2)
N1_1 Pt1 P1_5 91.12(19)
N1_2 Pt1 P2_5 91.98(18)
N1_1 Pt1 P2_5 178.11(19)
P1_5 Pt1 P2_5 90.77(10)
N1_3 Pt2 N9_1 85.5(2)
N1_3 Pt2 P2_6 177.8(2)
N9_1 Pt2 P2_6 92.31(17)
N1_3 Pt2 P1_6 91.7(2)
N9_1 Pt2 P1_6 177.05(17)
P2_6 Pt2 P1_6 90.47(9)
N1_4 Pt3 N17_1 84.3(3)
N1_4 Pt3 P2_7 93.25(19)
N17_1 Pt3 P2_7 177.5(2)
N1_4 Pt3 P1_7 175.83(19)
N17_1 Pt3 P1_7 92.0(2)
P2_7 Pt3 P1_7 90.51(9)
N17_2 Pt4 N9_3 84.1(2)
N17_2 Pt4 P1_8 92.75(17)
N9_3 Pt4 P1_8 176.8(2)
N17_2 Pt4 P2_8 176.66(16)
N9_3 Pt4 P2_8 92.6(2)
P1_8 Pt4 P2_8 90.59(9)
N9_2 Pt5 N17_4 85.4(3)
N9_2 Pt5 P1_9 174.7(2)
N17_4 Pt5 P1_9 90.3(2)
N9_2 Pt5 P2_9 91.7(2)
N17_4 Pt5 P2_9 177.1(2)
P1_9 Pt5 P2_9 92.62(11)
N9_4 Pt6 N17_3 86.5(3)
N9_4 Pt6 P2_10 178.8(2)
N17_3 Pt6 P2_10 92.35(18)
N9_4 Pt6 P1_10 91.0(2)
N17_3 Pt6 P1_10 177.31(18)
P2_10 Pt6 P1_10 90.19(9)
C2_1 N1_1 C6_1 117.7(6)
C2_1 N1_1 Pt1 120.7(5)
C6_1 N1_1 Pt1 121.5(5)
N1_1 C2_1 C3_1 123.5(6)
N1_1 C2_1 H2_1 118.3
C3_1 C2_1 H2_1 118.3
C2_1 C3_1 C4_1 118.7(6)
C2_1 C3_1 H3_1 120.6
C4_1 C3_1 H3_1 120.6
C3_1 C4_1 C5_1 117.9(6)
C3_1 C4_1 C7_1 121.7(7)
C5_1 C4_1 C7_1 120.4(6)
C6_1 C5_1 C4_1 119.7(6)
C6_1 C5_1 H5_1 120.2
C4_1 C5_1 H5_1 120.2
N1_1 C6_1 C5_1 122.4(7)
N1_1 C6_1 H6_1 118.8
C5_1 C6_1 H6_1 118.8
C8_1 C7_1 C4_1 176.5(12)
C7_1 C8_1 C25_1 176.4(12)
C26_1 C25_1 C30_1 120.0
C26_1 C25_1 C8_1 121.0(5)
C30_1 C25_1 C8_1 118.9(5)
O31_1 C26_1 C27_1 120.8(4)
O31_1 C26_1 C25_1 119.2(4)
C27_1 C26_1 C25_1 120.0
C34_1 O31_1 C26_1 119.7(11)
O31_1 C34_1 H34A_1 109.5
O31_1 C34_1 H34B_1 109.5
H34A_1 C34_1 H34B_1 109.5
O31_1 C34_1 H34C_1 109.5
H34A_1 C34_1 H34C_1 109.5
H34B_1 C34_1 H34C_1 109.5
C10_1 N9_1 C14_1 117.8(6)
C10_1 N9_1 Pt2 121.8(5)
C14_1 N9_1 Pt2 119.5(5)
N9_1 C10_1 C11_1 123.5(7)
N9_1 C10_1 H10_1 118.2
C11_1 C10_1 H10_1 118.2
C10_1 C11_1 C12_1 119.5(6)
C10_1 C11_1 H11_1 120.3
C12_1 C11_1 H11_1 120.3
C11_1 C12_1 C13_1 116.9(6)
C11_1 C12_1 C15_1 121.1(6)
C13_1 C12_1 C15_1 122.0(6)
C12_1 C13_1 C14_1 120.5(7)
C12_1 C13_1 H13_1 119.7
C14_1 C13_1 H13_1 119.7
N9_1 C14_1 C13_1 121.6(7)
N9_1 C14_1 H14_1 119.2
C13_1 C14_1 H14_1 119.2
C16_1 C15_1 C12_1 175.9(12)
C15_1 C16_1 C27_1 175.6(11)
C26_1 C27_1 C28_1 120.0
C26_1 C27_1 C16_1 121.2(5)
C28_1 C27_1 C16_1 118.8(5)
O32_1 C28_1 C29_1 119.6(4)
O32_1 C28_1 C27_1 120.4(4)
C29_1 C28_1 C27_1 120.0
C28_1 O32_1 C35_1 117.2(7)
O32_1 C35_1 H35A_1 109.5
O32_1 C35_1 H35B_1 109.5
H35A_1 C35_1 H35B_1 109.5
O32_1 C35_1 H35C_1 109.5
H35A_1 C35_1 H35C_1 109.5
H35B_1 C35_1 H35C_1 109.5
C18_1 N17_1 C22_1 118.5(6)
C18_1 N17_1 Pt3 121.6(5)
C22_1 N17_1 Pt3 119.9(5)
N17_1 C18_1 C19_1 122.0(6)
N17_1 C18_1 H18_1 119.0
C19_1 C18_1 H18_1 119.0
C18_1 C19_1 C20_1 120.1(6)
C18_1 C19_1 H19_1 119.9
C20_1 C19_1 H19_1 119.9
C21_1 C20_1 C19_1 117.5(6)
C21_1 C20_1 C23_1 121.0(6)
C19_1 C20_1 C23_1 121.3(6)
C22_1 C21_1 C20_1 118.9(6)
C22_1 C21_1 H21_1 120.6
C20_1 C21_1 H21_1 120.6
N17_1 C22_1 C21_1 123.0(6)
N17_1 C22_1 H22_1 118.5
C21_1 C22_1 H22_1 118.5
C24_1 C23_1 C20_1 179.0(11)
C23_1 C24_1 C29_1 177.4(10)
C30_1 C29_1 C28_1 120.0
C30_1 C29_1 C24_1 120.3(4)
C28_1 C29_1 C24_1 119.7(4)
O33_1 C30_1 C29_1 119.9(4)
O33_1 C30_1 C25_1 120.0(4)
C29_1 C30_1 C25_1 120.0
C30_1 O33_1 C36_1 117.3(10)
O33_1 C36_1 H36A_1 109.5
O33_1 C36_1 H36B_1 109.5
H36A_1 C36_1 H36B_1 109.5
O33_1 C36_1 H36C_1 109.5
H36A_1 C36_1 H36C_1 109.5
H36B_1 C36_1 H36C_1 109.5
C2_2 N1_2 C6_2 115.7(7)
C2_2 N1_2 Pt1 123.5(6)
C6_2 N1_2 Pt1 120.2(6)
N1_2 C2_2 C3_2 125.5(7)
N1_2 C2_2 H2_2 117.3
C3_2 C2_2 H2_2 117.3
C2_2 C3_2 C4_2 118.0(7)
C2_2 C3_2 H3_2 121.0
C4_2 C3_2 H3_2 121.0
C5_2 C4_2 C3_2 116.8(7)
C5_2 C4_2 C7_2 123.7(8)
C3_2 C4_2 C7_2 118.4(8)
C6_2 C5_2 C4_2 120.3(7)
C6_2 C5_2 H5_2 119.9
C4_2 C5_2 H5_2 119.9
N1_2 C6_2 C5_2 123.1(7)
N1_2 C6_2 H6_2 118.4
C5_2 C6_2 H6_2 118.4
C8_2 C7_2 C4_2 179.8(18)
C7_2 C8_2 C25_2 178.8(16)
C26_2 C25_2 C30_2 120.0
C26_2 C25_2 C8_2 118.1(6)
C30_2 C25_2 C8_2 121.9(6)
O31_2 C26_2 C25_2 119.0(6)
O31_2 C26_2 C27_2 120.9(6)
C25_2 C26_2 C27_2 120.0
C26_2 O31_2 C34_2 119.2(11)
O31_2 C34_2 H34A_2 109.5
O31_2 C34_2 H34B_2 109.5
H34A_2 C34_2 H34B_2 109.5
O31_2 C34_2 H34C_2 109.5
H34A_2 C34_2 H34C_2 109.5
H34B_2 C34_2 H34C_2 109.5
C14_2 N9_2 C10_2 117.6(7)
C14_2 N9_2 Pt5 119.0(6)
C10_2 N9_2 Pt5 123.3(6)
N9_2 C10_2 C11_2 123.4(7)
N9_2 C10_2 H10_2 118.3
C11_2 C10_2 H10_2 118.3
C10_2 C11_2 C12_2 118.3(7)
C10_2 C11_2 H11_2 120.9
C12_2 C11_2 H11_2 120.9
C11_2 C12_2 C13_2 119.1(7)
C11_2 C12_2 C15_2 121.1(7)
C13_2 C12_2 C15_2 119.7(7)
C14_2 C13_2 C12_2 117.9(7)
C14_2 C13_2 H13_2 121.0
C12_2 C13_2 H13_2 121.0
N9_2 C14_2 C13_2 123.5(7)
N9_2 C14_2 H14_2 118.3
C13_2 C14_2 H14_2 118.3
C16_2 C15_2 C12_2 177.9(13)
C15_2 C16_2 C27_2 175.4(13)
C28_2 C27_2 C26_2 120.0
C28_2 C27_2 C16_2 120.5(6)
C26_2 C27_2 C16_2 119.5(6)
O32_2 C28_2 C27_2 120.5(5)
O32_2 C28_2 C29_2 119.5(5)
C27_2 C28_2 C29_2 120.0
C28_2 O32_2 C35_2 117.3(10)
O32_2 C35_2 H35A_2 109.5
O32_2 C35_2 H35B_2 109.5
H35A_2 C35_2 H35B_2 109.5
O32_2 C35_2 H35C_2 109.5
H35A_2 C35_2 H35C_2 109.5
H35B_2 C35_2 H35C_2 109.5
C18_2 N17_2 C22_2 117.4(6)
C18_2 N17_2 Pt4 122.4(5)
C22_2 N17_2 Pt4 119.6(5)
N17_2 C18_2 C19_2 122.9(7)
N17_2 C18_2 H18_2 118.5
C19_2 C18_2 H18_2 118.5
C18_2 C19_2 C20_2 119.7(7)
C18_2 C19_2 H19_2 120.1
C20_2 C19_2 H19_2 120.1
C19_2 C20_2 C21_2 117.7(6)
C19_2 C20_2 C23_2 121.7(7)
C21_2 C20_2 C23_2 120.3(7)
C20_2 C21_2 C22_2 118.5(7)
C20_2 C21_2 H21_2 120.8
C22_2 C21_2 H21_2 120.8
N17_2 C22_2 C21_2 123.4(7)
N17_2 C22_2 H22_2 118.3
C21_2 C22_2 H22_2 118.3
C24_2 C23_2 C20_2 171.9(12)
C23_2 C24_2 C29_2 176.2(12)
C28_2 C29_2 C30_2 120.0
C28_2 C29_2 C24_2 117.7(5)
C30_2 C29_2 C24_2 122.3(5)
O33_2 C30_2 C29_2 121.1(5)
O33_2 C30_2 C25_2 118.9(5)
C29_2 C30_2 C25_2 120.0
C36_2 O33_2 C30_2 119.7(11)
O33_2 C36_2 H36A_2 109.5
O33_2 C36_2 H36B_2 109.5
H36A_2 C36_2 H36B_2 109.5
O33_2 C36_2 H36C_2 109.5
H36A_2 C36_2 H36C_2 109.5
H36B_2 C36_2 H36C_2 109.5
C6_3 N1_3 C2_3 117.1(6)
C6_3 N1_3 Pt2 121.6(5)
C2_3 N1_3 Pt2 121.2(5)
N1_3 C2_3 C3_3 123.3(6)
N1_3 C2_3 H2_3 118.4
C3_3 C2_3 H2_3 118.4
C2_3 C3_3 C4_3 119.0(6)
C2_3 C3_3 H3_3 120.5
C4_3 C3_3 H3_3 120.5
C5_3 C4_3 C3_3 117.6(6)
C5_3 C4_3 C7_3 121.8(6)
C3_3 C4_3 C7_3 120.3(6)
C6_3 C5_3 C4_3 119.0(6)
C6_3 C5_3 H5_3 120.5
C4_3 C5_3 H5_3 120.5
N1_3 C6_3 C5_3 123.8(6)
N1_3 C6_3 H6_3 118.1
C5_3 C6_3 H6_3 118.1
C8_3 C7_3 C4_3 177.1(10)
C7_3 C8_3 C25_3 178.0(11)
C26_3 C25_3 C30_3 120.0
C26_3 C25_3 C8_3 120.6(4)
C30_3 C25_3 C8_3 119.4(4)
O31_3 C26_3 C27_3 120.4(4)
O31_3 C26_3 C25_3 119.6(4)
C27_3 C26_3 C25_3 120.0
C26_3 O31_3 C34_3 113.9(9)
O31_3 C34_3 H34A_3 109.5
O31_3 C34_3 H34B_3 109.5
H34A_3 C34_3 H34B_3 109.5
O31_3 C34_3 H34C_3 109.5
H34A_3 C34_3 H34C_3 109.5
H34B_3 C34_3 H34C_3 109.5
C14_3 N9_3 C10_3 117.5(6)
C14_3 N9_3 Pt4 120.6(5)
C10_3 N9_3 Pt4 121.9(5)
N9_3 C10_3 C11_3 123.8(6)
N9_3 C10_3 H10_3 118.1
C11_3 C10_3 H10_3 118.1
C10_3 C11_3 C12_3 118.4(6)
C10_3 C11_3 H11_3 120.8
C12_3 C11_3 H11_3 120.8
C13_3 C12_3 C11_3 118.5(6)
C13_3 C12_3 C15_3 120.8(6)
C11_3 C12_3 C15_3 120.5(6)
C12_3 C13_3 C14_3 118.2(6)
C12_3 C13_3 H13_3 120.9
C14_3 C13_3 H13_3 120.9
N9_3 C14_3 C13_3 123.5(7)
N9_3 C14_3 H14_3 118.3
C13_3 C14_3 H14_3 118.3
C16_3 C15_3 C12_3 179.0(13)
C15_3 C16_3 C27_3 177.6(12)
C26_3 C27_3 C28_3 120.0
C26_3 C27_3 C16_3 121.1(5)
C28_3 C27_3 C16_3 118.9(5)
O32_3 C28_3 C29_3 120.2(4)
O32_3 C28_3 C27_3 119.7(4)
C29_3 C28_3 C27_3 120.0
C28_3 O32_3 C35_3 120.3(10)
O32_3 C35_3 H35A_3 109.5
O32_3 C35_3 H35B_3 109.5
H35A_3 C35_3 H35B_3 109.5
O32_3 C35_3 H35C_3 109.5
H35A_3 C35_3 H35C_3 109.5
H35B_3 C35_3 H35C_3 109.5
C18_3 N17_3 C22_3 116.7(6)
C18_3 N17_3 Pt6 122.5(5)
C22_3 N17_3 Pt6 120.6(5)
N17_3 C18_3 C19_3 123.9(7)
N17_3 C18_3 H18_3 118.1
C19_3 C18_3 H18_3 118.1
C18_3 C19_3 C20_3 119.3(6)
C18_3 C19_3 H19_3 120.3
C20_3 C19_3 H19_3 120.3
C19_3 C20_3 C21_3 116.8(6)
C19_3 C20_3 C23_3 121.8(6)
C21_3 C20_3 C23_3 121.1(6)
C22_3 C21_3 C20_3 120.4(7)
C22_3 C21_3 H21_3 119.8
C20_3 C21_3 H21_3 119.8
N17_3 C22_3 C21_3 122.8(7)
N17_3 C22_3 H22_3 118.6
C21_3 C22_3 H22_3 118.6
C24_3 C23_3 C20_3 175.8(9)
C23_3 C24_3 C29_3 176.7(10)
C28_3 C29_3 C30_3 120.0
C28_3 C29_3 C24_3 120.1(4)
C30_3 C29_3 C24_3 119.9(4)
O33_3 C30_3 C29_3 120.9(4)
O33_3 C30_3 C25_3 119.0(4)
C29_3 C30_3 C25_3 120.0
C30_3 O33_3 C36_3 117.6(7)
O33_3 C36_3 H36A_3 109.5
O33_3 C36_3 H36B_3 109.5
H36A_3 C36_3 H36B_3 109.5
O33_3 C36_3 H36C_3 109.5
H36A_3 C36_3 H36C_3 109.5
H36B_3 C36_3 H36C_3 109.5
C6_4 N1_4 C2_4 116.7(6)
C6_4 N1_4 Pt3 121.4(5)
C2_4 N1_4 Pt3 121.9(5)
N1_4 C2_4 C3_4 123.3(7)
N1_4 C2_4 H2_4 118.3
C3_4 C2_4 H2_4 118.3
C2_4 C3_4 C4_4 119.7(6)
C2_4 C3_4 H3_4 120.2
C4_4 C3_4 H3_4 120.2
C5_4 C4_4 C3_4 116.5(6)
C5_4 C4_4 C7_4 121.6(7)
C3_4 C4_4 C7_4 121.5(7)
C6_4 C5_4 C4_4 120.1(7)
C6_4 C5_4 H5_4 119.9
C4_4 C5_4 H5_4 119.9
N1_4 C6_4 C5_4 123.3(7)
N1_4 C6_4 H6_4 118.4
C5_4 C6_4 H6_4 118.4
C8_4 C7_4 C4_4 176.1(11)
C7_4 C8_4 C25_4 176.2(10)
C26_4 C25_4 C30_4 120.0
C26_4 C25_4 C8_4 119.3(4)
C30_4 C25_4 C8_4 120.7(4)
O31_4 C26_4 C27_4 119.9(4)
O31_4 C26_4 C25_4 120.0(4)
C27_4 C26_4 C25_4 120.0
C26_4 O31_4 C34_4 116.0(7)
O31_4 C34_4 H34A_4 109.5
O31_4 C34_4 H34B_4 109.5
H34A_4 C34_4 H34B_4 109.5
O31_4 C34_4 H34C_4 109.5
H34A_4 C34_4 H34C_4 109.5
H34B_4 C34_4 H34C_4 109.5
C14_4 N9_4 C10_4 118.2(6)
C14_4 N9_4 Pt6 120.5(5)
C10_4 N9_4 Pt6 121.3(5)
N9_4 C10_4 C11_4 123.0(7)
N9_4 C10_4 H10_4 118.5
C11_4 C10_4 H10_4 118.5
C12_4 C11_4 C10_4 119.0(6)
C12_4 C11_4 H11_4 120.5
C10_4 C11_4 H11_4 120.5
C11_4 C12_4 C13_4 117.2(6)
C11_4 C12_4 C15_4 121.1(6)
C13_4 C12_4 C15_4 121.5(6)
C14_4 C13_4 C12_4 120.5(6)
C14_4 C13_4 H13_4 119.8
C12_4 C13_4 H13_4 119.8
N9_4 C14_4 C13_4 121.9(7)
N9_4 C14_4 H14_4 119.0
C13_4 C14_4 H14_4 119.0
C16_4 C15_4 C12_4 179.0(12)
C15_4 C16_4 C27_4 173.8(11)
C26_4 C27_4 C28_4 120.0
C26_4 C27_4 C16_4 120.2(5)
C28_4 C27_4 C16_4 119.8(5)
O32_4 C28_4 C29_4 119.2(4)
O32_4 C28_4 C27_4 120.7(4)
C29_4 C28_4 C27_4 120.0
C28_4 O32_4 C35_4 114.3(10)
O32_4 C35_4 H35A_4 109.5
O32_4 C35_4 H35B_4 109.5
H35A_4 C35_4 H35B_4 109.5
O32_4 C35_4 H35C_4 109.5
H35A_4 C35_4 H35C_4 109.5
H35B_4 C35_4 H35C_4 109.5
C18_4 N17_4 C22_4 118.3(6)
C18_4 N17_4 Pt5 121.3(5)
C22_4 N17_4 Pt5 120.4(6)
N17_4 C18_4 C19_4 123.3(7)
N17_4 C18_4 H18_4 118.4
C19_4 C18_4 H18_4 118.4
C18_4 C19_4 C20_4 118.2(6)
C18_4 C19_4 H19_4 120.9
C20_4 C19_4 H19_4 120.9
C21_4 C20_4 C19_4 118.6(6)
C21_4 C20_4 C23_4 119.6(7)
C19_4 C20_4 C23_4 121.7(7)
C20_4 C21_4 C22_4 119.0(7)
C20_4 C21_4 H21_4 120.5
C22_4 C21_4 H21_4 120.5
N17_4 C22_4 C21_4 122.5(7)
N17_4 C22_4 H22_4 118.7
C21_4 C22_4 H22_4 118.7
C24_4 C23_4 C20_4 178.6(16)
C23_4 C24_4 C29_4 176.6(10)
C30_4 C29_4 C28_4 120.0
C30_4 C29_4 C24_4 121.2(5)
C28_4 C29_4 C24_4 118.8(5)
O33_4 C30_4 C29_4 121.5(4)
O33_4 C30_4 C25_4 118.5(4)
C29_4 C30_4 C25_4 120.0
C36_4 O33_4 C30_4 118.1(9)
O33_4 C36_4 H36A_4 109.5
O33_4 C36_4 H36B_4 109.5
H36A_4 C36_4 H36B_4 109.5
O33_4 C36_4 H36C_4 109.5
H36A_4 C36_4 H36C_4 109.5
H36B_4 C36_4 H36C_4 109.5
C2_5 C1_5 P1_5 114.1(5)
C2_5 C1_5 H1A_5 108.7
P1_5 C1_5 H1A_5 108.7
C2_5 C1_5 H1B_5 108.7
P1_5 C1_5 H1B_5 108.7
H1A_5 C1_5 H1B_5 107.6
C3_5 C2_5 C1_5 113.4(7)
C3_5 C2_5 H2A_5 108.9
C1_5 C2_5 H2A_5 108.9
C3_5 C2_5 H2B_5 108.9
C1_5 C2_5 H2B_5 108.9
H2A_5 C2_5 H2B_5 107.7
C2_5 C3_5 P2_5 115.0(6)
C2_5 C3_5 H3A_5 108.5
P2_5 C3_5 H3A_5 108.5
C2_5 C3_5 H3B_5 108.5
P2_5 C3_5 H3B_5 108.5
H3A_5 C3_5 H3B_5 107.5
C5_5 C4_5 C9_5 120.0
C5_5 C4_5 P1_5 119.6(5)
C9_5 C4_5 P1_5 120.4(5)
C4_5 C5_5 C6_5 120.0
C4_5 C5_5 H5_5 120.0
C6_5 C5_5 H5_5 120.0
C7_5 C6_5 C5_5 120.0
C7_5 C6_5 H6_5 120.0
C5_5 C6_5 H6_5 120.0
C8_5 C7_5 C6_5 120.0
C8_5 C7_5 H7_5 120.0
C6_5 C7_5 H7_5 120.0
C7_5 C8_5 C9_5 120.0
C7_5 C8_5 H8_5 120.0
C9_5 C8_5 H8_5 120.0
C8_5 C9_5 C4_5 120.0
C8_5 C9_5 H9_5 120.0
C4_5 C9_5 H9_5 120.0
C11_5 C10_5 C15_5 120.0
C11_5 C10_5 P1_5 119.9(5)
C15_5 C10_5 P1_5 120.0(5)
C10_5 C11_5 C12_5 120.0
C10_5 C11_5 H11_5 120.0
C12_5 C11_5 H11_5 120.0
C11_5 C12_5 C13_5 120.0
C11_5 C12_5 H12_5 120.0
C13_5 C12_5 H12_5 120.0
C14_5 C13_5 C12_5 120.0
C14_5 C13_5 H13_5 120.0
C12_5 C13_5 H13_5 120.0
C15_5 C14_5 C13_5 120.0
C15_5 C14_5 H14_5 120.0
C13_5 C14_5 H14_5 120.0
C14_5 C15_5 C10_5 120.0
C14_5 C15_5 H15_5 120.0
C10_5 C15_5 H15_5 120.0
C17_5 C16_5 C21_5 120.0
C17_5 C16_5 P2_5 119.8(5)
C21_5 C16_5 P2_5 120.2(5)
C18_5 C17_5 C16_5 120.0
C18_5 C17_5 H17_5 120.0
C16_5 C17_5 H17_5 120.0
C19_5 C18_5 C17_5 120.0
C19_5 C18_5 H18_5 120.0
C17_5 C18_5 H18_5 120.0
C18_5 C19_5 C20_5 120.0
C18_5 C19_5 H19_5 120.0
C20_5 C19_5 H19_5 120.0
C21_5 C20_5 C19_5 120.0
C21_5 C20_5 H20_5 120.0
C19_5 C20_5 H20_5 120.0
C20_5 C21_5 C16_5 120.0
C20_5 C21_5 H21_5 120.0
C16_5 C21_5 H21_5 120.0
C23_5 C22_5 C27_5 120.0
C23_5 C22_5 P2_5 119.0(5)
C27_5 C22_5 P2_5 120.9(5)
C24_5 C23_5 C22_5 120.0
C24_5 C23_5 H23_5 120.0
C22_5 C23_5 H23_5 120.0
C25_5 C24_5 C23_5 120.0
C25_5 C24_5 H24_5 120.0
C23_5 C24_5 H24_5 120.0
C24_5 C25_5 C26_5 120.0
C24_5 C25_5 H25_5 120.0
C26_5 C25_5 H25_5 120.0
C27_5 C26_5 C25_5 120.0
C27_5 C26_5 H26_5 120.0
C25_5 C26_5 H26_5 120.0
C26_5 C27_5 C22_5 120.0
C26_5 C27_5 H27_5 120.0
C22_5 C27_5 H27_5 120.0
C10_5 P1_5 C4_5 105.3(3)
C10_5 P1_5 C1_5 104.3(3)
C4_5 P1_5 C1_5 107.6(4)
C10_5 P1_5 Pt1 111.5(2)
C4_5 P1_5 Pt1 113.1(3)
C1_5 P1_5 Pt1 114.2(3)
C22_5 P2_5 C16_5 102.4(4)
C22_5 P2_5 C3_5 104.4(4)
C16_5 P2_5 C3_5 107.0(4)
C22_5 P2_5 Pt1 114.3(3)
C16_5 P2_5 Pt1 114.0(3)
C3_5 P2_5 Pt1 113.7(3)
C2_6 C1_6 P1_6 115.6(5)
C2_6 C1_6 H1A_6 108.4
P1_6 C1_6 H1A_6 108.4
C2_6 C1_6 H1B_6 108.4
P1_6 C1_6 H1B_6 108.4
H1A_6 C1_6 H1B_6 107.4
C3_6 C2_6 C1_6 113.5(7)
C3_6 C2_6 H2A_6 108.9
C1_6 C2_6 H2A_6 108.9
C3_6 C2_6 H2B_6 108.9
C1_6 C2_6 H2B_6 108.9
H2A_6 C2_6 H2B_6 107.7
C2_6 C3_6 P2_6 115.5(5)
C2_6 C3_6 H3A_6 108.4
P2_6 C3_6 H3A_6 108.4
C2_6 C3_6 H3B_6 108.4
P2_6 C3_6 H3B_6 108.4
H3A_6 C3_6 H3B_6 107.5
C5_6 C4_6 C9_6 120.0
C5_6 C4_6 P1_6 119.5(4)
C9_6 C4_6 P1_6 120.5(4)
C6_6 C5_6 C4_6 120.0
C6_6 C5_6 H5_6 120.0
C4_6 C5_6 H5_6 120.0
C5_6 C6_6 C7_6 120.0
C5_6 C6_6 H6_6 120.0
C7_6 C6_6 H6_6 120.0
C6_6 C7_6 C8_6 120.0
C6_6 C7_6 H7_6 120.0
C8_6 C7_6 H7_6 120.0
C9_6 C8_6 C7_6 120.0
C9_6 C8_6 H8_6 120.0
C7_6 C8_6 H8_6 120.0
C8_6 C9_6 C4_6 120.0
C8_6 C9_6 H9_6 120.0
C4_6 C9_6 H9_6 120.0
C11_6 C10_6 C15_6 120.0
C11_6 C10_6 P1_6 120.2(4)
C15_6 C10_6 P1_6 119.8(4)
C10_6 C11_6 C12_6 120.0
C10_6 C11_6 H11_6 120.0
C12_6 C11_6 H11_6 120.0
C13_6 C12_6 C11_6 120.0
C13_6 C12_6 H12_6 120.0
C11_6 C12_6 H12_6 120.0
C12_6 C13_6 C14_6 120.0
C12_6 C13_6 H13_6 120.0
C14_6 C13_6 H13_6 120.0
C13_6 C14_6 C15_6 120.0
C13_6 C14_6 H14_6 120.0
C15_6 C14_6 H14_6 120.0
C14_6 C15_6 C10_6 120.0
C14_6 C15_6 H15_6 120.0
C10_6 C15_6 H15_6 120.0
C17_6 C16_6 C21_6 120.0
C17_6 C16_6 P2_6 119.2(4)
C21_6 C16_6 P2_6 120.8(4)
C16_6 C17_6 C18_6 120.0
C16_6 C17_6 H17_6 120.0
C18_6 C17_6 H17_6 120.0
C17_6 C18_6 C19_6 120.0
C17_6 C18_6 H18_6 120.0
C19_6 C18_6 H18_6 120.0
C20_6 C19_6 C18_6 120.0
C20_6 C19_6 H19_6 120.0
C18_6 C19_6 H19_6 120.0
C19_6 C20_6 C21_6 120.0
C19_6 C20_6 H20_6 120.0
C21_6 C20_6 H20_6 120.0
C20_6 C21_6 C16_6 120.0
C20_6 C21_6 H21_6 120.0
C16_6 C21_6 H21_6 120.0
C23_6 C22_6 C27_6 120.0
C23_6 C22_6 P2_6 118.8(4)
C27_6 C22_6 P2_6 121.2(4)
C24_6 C23_6 C22_6 120.0
C24_6 C23_6 H23_6 120.0
C22_6 C23_6 H23_6 120.0
C23_6 C24_6 C25_6 120.0
C23_6 C24_6 H24_6 120.0
C25_6 C24_6 H24_6 120.0
C24_6 C25_6 C26_6 120.0
C24_6 C25_6 H25_6 120.0
C26_6 C25_6 H25_6 120.0
C27_6 C26_6 C25_6 120.0
C27_6 C26_6 H26_6 120.0
C25_6 C26_6 H26_6 120.0
C26_6 C27_6 C22_6 120.0
C26_6 C27_6 H27_6 120.0
C22_6 C27_6 H27_6 120.0
C10_6 P1_6 C4_6 104.2(3)
C10_6 P1_6 C1_6 104.9(3)
C4_6 P1_6 C1_6 107.9(4)
C10_6 P1_6 Pt2 112.3(2)
C4_6 P1_6 Pt2 113.5(2)
C1_6 P1_6 Pt2 113.2(3)
C16_6 P2_6 C22_6 104.4(3)
C16_6 P2_6 C3_6 107.6(3)
C22_6 P2_6 C3_6 103.3(3)
C16_6 P2_6 Pt2 113.9(2)
C22_6 P2_6 Pt2 113.1(2)
C3_6 P2_6 Pt2 113.5(3)
C2_7 C1_7 P1_7 115.6(5)
C2_7 C1_7 H1A_7 108.4
P1_7 C1_7 H1A_7 108.4
C2_7 C1_7 H1B_7 108.4
P1_7 C1_7 H1B_7 108.4
H1A_7 C1_7 H1B_7 107.4
C3_7 C2_7 C1_7 113.1(7)
C3_7 C2_7 H2A_7 109.0
C1_7 C2_7 H2A_7 109.0
C3_7 C2_7 H2B_7 109.0
C1_7 C2_7 H2B_7 109.0
H2A_7 C2_7 H2B_7 107.8
C2_7 C3_7 P2_7 115.0(5)
C2_7 C3_7 H3A_7 108.5
P2_7 C3_7 H3A_7 108.5
C2_7 C3_7 H3B_7 108.5
P2_7 C3_7 H3B_7 108.5
H3A_7 C3_7 H3B_7 107.5
C5_7 C4_7 C9_7 120.0
C5_7 C4_7 P1_7 120.6(4)
C9_7 C4_7 P1_7 119.4(4)
C6_7 C5_7 C4_7 120.0
C6_7 C5_7 H5_7 120.0
C4_7 C5_7 H5_7 120.0
C7_7 C6_7 C5_7 120.0
C7_7 C6_7 H6_7 120.0
C5_7 C6_7 H6_7 120.0
C6_7 C7_7 C8_7 120.0
C6_7 C7_7 H7_7 120.0
C8_7 C7_7 H7_7 120.0
C9_7 C8_7 C7_7 120.0
C9_7 C8_7 H8_7 120.0
C7_7 C8_7 H8_7 120.0
C8_7 C9_7 C4_7 120.0
C8_7 C9_7 H9_7 120.0
C4_7 C9_7 H9_7 120.0
C11_7 C10_7 C15_7 120.0
C11_7 C10_7 P1_7 120.4(4)
C15_7 C10_7 P1_7 119.6(4)
C12_7 C11_7 C10_7 120.0
C12_7 C11_7 H11_7 120.0
C10_7 C11_7 H11_7 120.0
C11_7 C12_7 C13_7 120.0
C11_7 C12_7 H12_7 120.0
C13_7 C12_7 H12_7 120.0
C14_7 C13_7 C12_7 120.0
C14_7 C13_7 H13_7 120.0
C12_7 C13_7 H13_7 120.0
C15_7 C14_7 C13_7 120.0
C15_7 C14_7 H14_7 120.0
C13_7 C14_7 H14_7 120.0
C14_7 C15_7 C10_7 120.0
C14_7 C15_7 H15_7 120.0
C10_7 C15_7 H15_7 120.0
C17_7 C16_7 C21_7 120.0
C17_7 C16_7 P2_7 118.9(3)
C21_7 C16_7 P2_7 121.1(3)
C18_7 C17_7 C16_7 120.0
C18_7 C17_7 H17_7 120.0
C16_7 C17_7 H17_7 120.0
C17_7 C18_7 C19_7 120.0
C17_7 C18_7 H18_7 120.0
C19_7 C18_7 H18_7 120.0
C20_7 C19_7 C18_7 120.0
C20_7 C19_7 H19_7 120.0
C18_7 C19_7 H19_7 120.0
C19_7 C20_7 C21_7 120.0
C19_7 C20_7 H20_7 120.0
C21_7 C20_7 H20_7 120.0
C20_7 C21_7 C16_7 120.0
C20_7 C21_7 H21_7 120.0
C16_7 C21_7 H21_7 120.0
C23_7 C22_7 C27_7 120.0
C23_7 C22_7 P2_7 119.0(4)
C27_7 C22_7 P2_7 121.0(4)
C24_7 C23_7 C22_7 120.0
C24_7 C23_7 H23_7 120.0
C22_7 C23_7 H23_7 120.0
C25_7 C24_7 C23_7 120.0
C25_7 C24_7 H24_7 120.0
C23_7 C24_7 H24_7 120.0
C24_7 C25_7 C26_7 120.0
C24_7 C25_7 H25_7 120.0
C26_7 C25_7 H25_7 120.0
C25_7 C26_7 C27_7 120.0
C25_7 C26_7 H26_7 120.0
C27_7 C26_7 H26_7 120.0
C26_7 C27_7 C22_7 120.0
C26_7 C27_7 H27_7 120.0
C22_7 C27_7 H27_7 120.0
C1_7 P1_7 C10_7 105.3(3)
C1_7 P1_7 C4_7 108.6(3)
C10_7 P1_7 C4_7 104.7(3)
C1_7 P1_7 Pt3 112.8(3)
C10_7 P1_7 Pt3 112.0(2)
C4_7 P1_7 Pt3 112.9(2)
C22_7 P2_7 C16_7 104.9(3)
C22_7 P2_7 C3_7 103.9(3)
C16_7 P2_7 C3_7 107.8(3)
C22_7 P2_7 Pt3 113.4(2)
C16_7 P2_7 Pt3 112.9(2)
C3_7 P2_7 Pt3 113.3(3)
C2_8 C1_8 P1_8 112.8(5)
C2_8 C1_8 H1A_8 109.0
P1_8 C1_8 H1A_8 109.0
C2_8 C1_8 H1B_8 109.0
P1_8 C1_8 H1B_8 109.0
H1A_8 C1_8 H1B_8 107.8
C3_8 C2_8 C1_8 111.7(7)
C3_8 C2_8 H2A_8 109.3
C1_8 C2_8 H2A_8 109.3
C3_8 C2_8 H2B_8 109.3
C1_8 C2_8 H2B_8 109.3
H2A_8 C2_8 H2B_8 107.9
C2_8 C3_8 P2_8 115.1(6)
C2_8 C3_8 H3A_8 108.5
P2_8 C3_8 H3A_8 108.5
C2_8 C3_8 H3B_8 108.5
P2_8 C3_8 H3B_8 108.5
H3A_8 C3_8 H3B_8 107.5
C5_8 C4_8 C9_8 120.0
C5_8 C4_8 P1_8 119.8(3)
C9_8 C4_8 P1_8 120.2(4)
C4_8 C5_8 C6_8 120.0
C4_8 C5_8 H5_8 120.0
C6_8 C5_8 H5_8 120.0
C7_8 C6_8 C5_8 120.0
C7_8 C6_8 H6_8 120.0
C5_8 C6_8 H6_8 120.0
C8_8 C7_8 C6_8 120.0
C8_8 C7_8 H7_8 120.0
C6_8 C7_8 H7_8 120.0
C7_8 C8_8 C9_8 120.0
C7_8 C8_8 H8_8 120.0
C9_8 C8_8 H8_8 120.0
C8_8 C9_8 C4_8 120.0
C8_8 C9_8 H9_8 120.0
C4_8 C9_8 H9_8 120.0
C11_8 C10_8 C15_8 120.0
C11_8 C10_8 P1_8 120.7(5)
C15_8 C10_8 P1_8 119.2(5)
C12_8 C11_8 C10_8 120.0
C12_8 C11_8 H11_8 120.0
C10_8 C11_8 H11_8 120.0
C13_8 C12_8 C11_8 120.0
C13_8 C12_8 H12_8 120.0
C11_8 C12_8 H12_8 120.0
C12_8 C13_8 C14_8 120.0
C12_8 C13_8 H13_8 120.0
C14_8 C13_8 H13_8 120.0
C15_8 C14_8 C13_8 120.0
C15_8 C14_8 H14_8 120.0
C13_8 C14_8 H14_8 120.0
C14_8 C15_8 C10_8 120.0
C14_8 C15_8 H15_8 120.0
C10_8 C15_8 H15_8 120.0
C17_8 C16_8 C21_8 120.0
C17_8 C16_8 P2_8 118.8(4)
C21_8 C16_8 P2_8 121.2(4)
C18_8 C17_8 C16_8 120.0
C18_8 C17_8 H17_8 120.0
C16_8 C17_8 H17_8 120.0
C17_8 C18_8 C19_8 120.0
C17_8 C18_8 H18_8 120.0
C19_8 C18_8 H18_8 120.0
C20_8 C19_8 C18_8 120.0
C20_8 C19_8 H19_8 120.0
C18_8 C19_8 H19_8 120.0
C21_8 C20_8 C19_8 120.0
C21_8 C20_8 H20_8 120.0
C19_8 C20_8 H20_8 120.0
C20_8 C21_8 C16_8 120.0
C20_8 C21_8 H21_8 120.0
C16_8 C21_8 H21_8 120.0
C23_8 C22_8 C27_8 120.0
C23_8 C22_8 P2_8 118.7(5)
C27_8 C22_8 P2_8 121.1(5)
C22_8 C23_8 C24_8 120.0
C22_8 C23_8 H23_8 120.0
C24_8 C23_8 H23_8 120.0
C25_8 C24_8 C23_8 120.0
C25_8 C24_8 H24_8 120.0
C23_8 C24_8 H24_8 120.0
C24_8 C25_8 C26_8 120.0
C24_8 C25_8 H25_8 120.0
C26_8 C25_8 H25_8 120.0
C27_8 C26_8 C25_8 120.0
C27_8 C26_8 H26_8 120.0
C25_8 C26_8 H26_8 120.0
C26_8 C27_8 C22_8 120.0
C26_8 C27_8 H27_8 120.0
C22_8 C27_8 H27_8 120.0
C10_8 P1_8 C4_8 105.7(3)
C10_8 P1_8 C1_8 105.8(4)
C4_8 P1_8 C1_8 106.2(3)
C10_8 P1_8 Pt4 111.1(2)
C4_8 P1_8 Pt4 115.6(2)
C1_8 P1_8 Pt4 111.8(3)
C3_8 P2_8 C22_8 103.2(4)
C3_8 P2_8 C16_8 107.1(4)
C22_8 P2_8 C16_8 106.0(3)
C3_8 P2_8 Pt4 115.0(3)
C22_8 P2_8 Pt4 112.5(3)
C16_8 P2_8 Pt4 112.2(2)
C2_9 C1_9 P1_9 112.8(6)
C2_9 C1_9 H1A_9 109.0
P1_9 C1_9 H1A_9 109.0
C2_9 C1_9 H1B_9 109.0
P1_9 C1_9 H1B_9 109.0
H1A_9 C1_9 H1B_9 107.8
C3_9 C2_9 C1_9 110.4(7)
C3_9 C2_9 H2A_9 109.6
C1_9 C2_9 H2A_9 109.6
C3_9 C2_9 H2B_9 109.6
C1_9 C2_9 H2B_9 109.6
H2A_9 C2_9 H2B_9 108.1
C2_9 C3_9 P2_9 113.5(6)
C2_9 C3_9 H3A_9 108.9
P2_9 C3_9 H3A_9 108.9
C2_9 C3_9 H3B_9 108.9
P2_9 C3_9 H3B_9 108.9
H3A_9 C3_9 H3B_9 107.7
C5_9 C4_9 C9_9 120.0
C5_9 C4_9 P1_9 121.1(6)
C9_9 C4_9 P1_9 118.9(6)
C6_9 C5_9 C4_9 120.0
C6_9 C5_9 H5_9 120.0
C4_9 C5_9 H5_9 120.0
C5_9 C6_9 C7_9 120.0
C5_9 C6_9 H6_9 120.0
C7_9 C6_9 H6_9 120.0
C8_9 C7_9 C6_9 120.0
C8_9 C7_9 H7_9 120.0
C6_9 C7_9 H7_9 120.0
C7_9 C8_9 C9_9 120.0
C7_9 C8_9 H8_9 120.0
C9_9 C8_9 H8_9 120.0
C8_9 C9_9 C4_9 120.0
C8_9 C9_9 H9_9 120.0
C4_9 C9_9 H9_9 120.0
C11_9 C10_9 C15_9 120.0
C11_9 C10_9 P1_9 119.7(5)
C15_9 C10_9 P1_9 120.2(5)
C12_9 C11_9 C10_9 120.0
C12_9 C11_9 H11_9 120.0
C10_9 C11_9 H11_9 120.0
C13_9 C12_9 C11_9 120.0
C13_9 C12_9 H12_9 120.0
C11_9 C12_9 H12_9 120.0
C14_9 C13_9 C12_9 120.0
C14_9 C13_9 H13_9 120.0
C12_9 C13_9 H13_9 120.0
C13_9 C14_9 C15_9 120.0
C13_9 C14_9 H14_9 120.0
C15_9 C14_9 H14_9 120.0
C14_9 C15_9 C10_9 120.0
C14_9 C15_9 H15_9 120.0
C10_9 C15_9 H15_9 120.0
C17_9 C16_9 C21_9 120.0
C17_9 C16_9 P2_9 119.5(5)
C21_9 C16_9 P2_9 120.5(5)
C16_9 C17_9 C18_9 120.0
C16_9 C17_9 H17_9 120.0
C18_9 C17_9 H17_9 120.0
C19_9 C18_9 C17_9 120.0
C19_9 C18_9 H18_9 120.0
C17_9 C18_9 H18_9 120.0
C18_9 C19_9 C20_9 120.0
C18_9 C19_9 H19_9 120.0
C20_9 C19_9 H19_9 120.0
C21_9 C20_9 C19_9 120.0
C21_9 C20_9 H20_9 120.0
C19_9 C20_9 H20_9 120.0
C20_9 C21_9 C16_9 120.0
C20_9 C21_9 H21_9 120.0
C16_9 C21_9 H21_9 120.0
C23_9 C22_9 C27_9 120.0
C23_9 C22_9 P2_9 120.2(5)
C27_9 C22_9 P2_9 119.7(5)
C24_9 C23_9 C22_9 120.0
C24_9 C23_9 H23_9 120.0
C22_9 C23_9 H23_9 120.0
C25_9 C24_9 C23_9 120.0
C25_9 C24_9 H24_9 120.0
C23_9 C24_9 H24_9 120.0
C24_9 C25_9 C26_9 120.0
C24_9 C25_9 H25_9 120.0
C26_9 C25_9 H25_9 120.0
C27_9 C26_9 C25_9 120.0
C27_9 C26_9 H26_9 120.0
C25_9 C26_9 H26_9 120.0
C26_9 C27_9 C22_9 120.0
C26_9 C27_9 H27_9 120.0
C22_9 C27_9 H27_9 120.0
C10_9 P1_9 C1_9 103.3(4)
C10_9 P1_9 C4_9 106.7(4)
C1_9 P1_9 C4_9 107.2(4)
C10_9 P1_9 Pt5 112.5(3)
C1_9 P1_9 Pt5 112.8(4)
C4_9 P1_9 Pt5 113.7(3)
C16_9 P2_9 C22_9 103.6(4)
C16_9 P2_9 C3_9 107.0(4)
C22_9 P2_9 C3_9 105.1(4)
C16_9 P2_9 Pt5 113.9(3)
C22_9 P2_9 Pt5 112.1(2)
C3_9 P2_9 Pt5 114.2(3)
C2_10 C1_10 P1_10 114.1(5)
C2_10 C1_10 H1A_10 108.7
P1_10 C1_10 H1A_10 108.7
C2_10 C1_10 H1B_10 108.7
P1_10 C1_10 H1B_10 108.7
H1A_10 C1_10 H1B_10 107.6
C1_10 C2_10 C3_10 114.7(7)
C1_10 C2_10 H2A_10 108.6
C3_10 C2_10 H2A_10 108.6
C1_10 C2_10 H2B_10 108.6
C3_10 C2_10 H2B_10 108.6
H2A_10 C2_10 H2B_10 107.6
C2_10 C3_10 P2_10 115.1(5)
C2_10 C3_10 H3A_10 108.5
P2_10 C3_10 H3A_10 108.5
C2_10 C3_10 H3B_10 108.5
P2_10 C3_10 H3B_10 108.5
H3A_10 C3_10 H3B_10 107.5
C5_10 C4_10 C9_10 120.0
C5_10 C4_10 P1_10 119.6(4)
C9_10 C4_10 P1_10 120.4(4)
C4_10 C5_10 C6_10 120.0
C4_10 C5_10 H5_10 120.0
C6_10 C5_10 H5_10 120.0
C7_10 C6_10 C5_10 120.0
C7_10 C6_10 H6_10 120.0
C5_10 C6_10 H6_10 120.0
C6_10 C7_10 C8_10 120.0
C6_10 C7_10 H7_10 120.0
C8_10 C7_10 H7_10 120.0
C9_10 C8_10 C7_10 120.0
C9_10 C8_10 H8_10 120.0
C7_10 C8_10 H8_10 120.0
C8_10 C9_10 C4_10 120.0
C8_10 C9_10 H9_10 120.0
C4_10 C9_10 H9_10 120.0
C11_10 C10_10 C15_10 120.0
C11_10 C10_10 P1_10 120.1(4)
C15_10 C10_10 P1_10 119.9(4)
C10_10 C11_10 C12_10 120.0
C10_10 C11_10 H11_10 120.0
C12_10 C11_10 H11_10 120.0
C13_10 C12_10 C11_10 120.0
C13_10 C12_10 H12_10 120.0
C11_10 C12_10 H12_10 120.0
C12_10 C13_10 C14_10 120.0
C12_10 C13_10 H13_10 120.0
C14_10 C13_10 H13_10 120.0
C15_10 C14_10 C13_10 120.0
C15_10 C14_10 H14_10 120.0
C13_10 C14_10 H14_10 120.0
C14_10 C15_10 C10_10 120.0
C14_10 C15_10 H15_10 120.0
C10_10 C15_10 H15_10 120.0
C17_10 C16_10 C21_10 120.0
C17_10 C16_10 P2_10 118.4(3)
C21_10 C16_10 P2_10 121.6(3)
C18_10 C17_10 C16_10 120.0
C18_10 C17_10 H17_10 120.0
C16_10 C17_10 H17_10 120.0
C17_10 C18_10 C19_10 120.0
C17_10 C18_10 H18_10 120.0
C19_10 C18_10 H18_10 120.0
C20_10 C19_10 C18_10 120.0
C20_10 C19_10 H19_10 120.0
C18_10 C19_10 H19_10 120.0
C19_10 C20_10 C21_10 120.0
C19_10 C20_10 H20_10 120.0
C21_10 C20_10 H20_10 120.0
C20_10 C21_10 C16_10 120.0
C20_10 C21_10 H21_10 120.0
C16_10 C21_10 H21_10 120.0
C23_10 C22_10 C27_10 120.0
C23_10 C22_10 P2_10 119.0(4)
C27_10 C22_10 P2_10 121.0(4)
C24_10 C23_10 C22_10 120.0
C24_10 C23_10 H23_10 120.0
C22_10 C23_10 H23_10 120.0
C25_10 C24_10 C23_10 120.0
C25_10 C24_10 H24_10 120.0
C23_10 C24_10 H24_10 120.0
C24_10 C25_10 C26_10 120.0
C24_10 C25_10 H25_10 120.0
C26_10 C25_10 H25_10 120.0
C27_10 C26_10 C25_10 120.0
C27_10 C26_10 H26_10 120.0
C25_10 C26_10 H26_10 120.0
C26_10 C27_10 C22_10 120.0
C26_10 C27_10 H27_10 120.0
C22_10 C27_10 H27_10 120.0
C1_10 P1_10 C4_10 108.4(3)
C1_10 P1_10 C10_10 104.3(3)
C4_10 P1_10 C10_10 103.3(3)
C1_10 P1_10 Pt6 114.3(3)
C4_10 P1_10 Pt6 112.9(2)
C10_10 P1_10 Pt6 112.8(3)
C16_10 P2_10 C22_10 105.8(3)
C16_10 P2_10 C3_10 108.1(3)
C22_10 P2_10 C3_10 103.7(3)
C16_10 P2_10 Pt6 113.5(2)
C22_10 P2_10 Pt6 112.1(2)
C3_10 P2_10 Pt6 113.0(3)
F2_11 C1_11 F3_11 107.9
F2_11 C1_11 F1_11 107.9
F3_11 C1_11 F1_11 107.6
F2_11 C1_11 S1_11 111.6
F3_11 C1_11 S1_11 110.4
F1_11 C1_11 S1_11 111.3
O3_11 S1_11 O1_11 116.1
O3_11 S1_11 O2_11 114.8
O1_11 S1_11 O2_11 113.7
O3_11 S1_11 C1_11 104.0
O1_11 S1_11 C1_11 104.0
O2_11 S1_11 C1_11 101.9
F2_12 C1_12 F3_12 107.9
F2_12 C1_12 F1_12 107.9
F3_12 C1_12 F1_12 107.6
F2_12 C1_12 S1_12 111.6
F3_12 C1_12 S1_12 110.4
F1_12 C1_12 S1_12 111.2
O3_12 S1_12 O1_12 116.1
O3_12 S1_12 O2_12 114.8
O1_12 S1_12 O2_12 113.7
O3_12 S1_12 C1_12 104.0
O1_12 S1_12 C1_12 104.0
O2_12 S1_12 C1_12 101.9
F2_13 C1_13 F3_13 107.9
F2_13 C1_13 F1_13 107.9
F3_13 C1_13 F1_13 107.6
F2_13 C1_13 S1_13 111.6
F3_13 C1_13 S1_13 110.4
F1_13 C1_13 S1_13 111.3
O3_13 S1_13 O1_13 116.0
O3_13 S1_13 O2_13 114.8
O1_13 S1_13 O2_13 113.7
O3_13 S1_13 C1_13 104.0
O1_13 S1_13 C1_13 104.0
O2_13 S1_13 C1_13 101.9
F3_14 C1_14 F2_14 107.9
F3_14 C1_14 F1_14 107.6
F2_14 C1_14 F1_14 107.9
F3_14 C1_14 S1_14 110.4
F2_14 C1_14 S1_14 111.6
F1_14 C1_14 S1_14 111.3
O3_14 S1_14 O1_14 116.1
O3_14 S1_14 O2_14 114.8
O1_14 S1_14 O2_14 113.7
O3_14 S1_14 C1_14 104.0
O1_14 S1_14 C1_14 104.0
O2_14 S1_14 C1_14 101.9
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
Pt1 N1_2 2.069(6)
Pt1 N1_1 2.076(6)
Pt1 P1_5 2.256(3)
Pt1 P2_5 2.257(2)
Pt2 N1_3 2.087(6)
Pt2 N9_1 2.096(6)
Pt2 P2_6 2.254(2)
Pt2 P1_6 2.264(3)
Pt3 N1_4 2.085(7)
Pt3 N17_1 2.094(6)
Pt3 P2_7 2.258(3)
Pt3 P1_7 2.262(3)
Pt4 N17_2 2.077(7)
Pt4 N9_3 2.097(6)
Pt4 P1_8 2.252(2)
Pt4 P2_8 2.257(3)
Pt5 N9_2 2.067(7)
Pt5 N17_4 2.090(6)
Pt5 P1_9 2.242(3)
Pt5 P2_9 2.259(3)
Pt6 N9_4 2.087(6)
Pt6 N17_3 2.099(6)
Pt6 P2_10 2.255(2)
Pt6 P1_10 2.268(3)
N1_1 C2_1 1.326(6)
N1_1 C6_1 1.328(6)
C2_1 C3_1 1.372(6)
C2_1 H2_1 0.9300
C3_1 C4_1 1.376(6)
C3_1 H3_1 0.9300
C4_1 C5_1 1.380(6)
C4_1 C7_1 1.450(6)
C5_1 C6_1 1.369(6)
C5_1 H5_1 0.9300
C6_1 H6_1 0.9300
C7_1 C8_1 1.173(6)
C8_1 C25_1 1.442(6)
C25_1 C26_1 1.3900
C25_1 C30_1 1.3900
C26_1 O31_1 1.367(5)
C26_1 C27_1 1.3900
O31_1 C34_1 1.361(8)
C34_1 H34A_1 0.9600
C34_1 H34B_1 0.9600
C34_1 H34C_1 0.9600
N9_1 C10_1 1.315(6)
N9_1 C14_1 1.328(6)
C10_1 C11_1 1.366(6)
C10_1 H10_1 0.9300
C11_1 C12_1 1.369(6)
C11_1 H11_1 0.9300
C12_1 C13_1 1.373(6)
C12_1 C15_1 1.449(6)
C13_1 C14_1 1.373(6)
C13_1 H13_1 0.9300
C14_1 H14_1 0.9300
C15_1 C16_1 1.176(6)
C16_1 C27_1 1.447(6)
C27_1 C28_1 1.3900
C28_1 O32_1 1.353(5)
C28_1 C29_1 1.3900
O32_1 C35_1 1.382(7)
C35_1 H35A_1 0.9600
C35_1 H35B_1 0.9600
C35_1 H35C_1 0.9600
N17_1 C18_1 1.310(6)
N17_1 C22_1 1.333(6)
C18_1 C19_1 1.371(6)
C18_1 H18_1 0.9300
C19_1 C20_1 1.377(6)
C19_1 H19_1 0.9300
C20_1 C21_1 1.377(6)
C20_1 C23_1 1.447(6)
C21_1 C22_1 1.366(6)
C21_1 H21_1 0.9300
C22_1 H22_1 0.9300
C23_1 C24_1 1.175(6)
C24_1 C29_1 1.445(6)
C29_1 C30_1 1.3900
C30_1 O33_1 1.361(5)
O33_1 C36_1 1.380(8)
C36_1 H36A_1 0.9600
C36_1 H36B_1 0.9600
C36_1 H36C_1 0.9600
N1_2 C2_2 1.313(6)
N1_2 C6_2 1.325(6)
C2_2 C3_2 1.373(6)
C2_2 H2_2 0.9300
C3_2 C4_2 1.377(6)
C3_2 H3_2 0.9300
C4_2 C5_2 1.372(6)
C4_2 C7_2 1.438(7)
C5_2 C6_2 1.369(6)
C5_2 H5_2 0.9300
C6_2 H6_2 0.9300
C7_2 C8_2 1.171(6)
C8_2 C25_2 1.439(6)
C25_2 C26_2 1.3900
C25_2 C30_2 1.3900
C26_2 O31_2 1.356(6)
C26_2 C27_2 1.3900
O31_2 C34_2 1.375(8)
C34_2 H34A_2 0.9600
C34_2 H34B_2 0.9600
C34_2 H34C_2 0.9600
N9_2 C14_2 1.319(6)
N9_2 C10_2 1.330(6)
C10_2 C11_2 1.366(6)
C10_2 H10_2 0.9300
C11_2 C12_2 1.369(6)
C11_2 H11_2 0.9300
C12_2 C13_2 1.385(6)
C12_2 C15_2 1.448(7)
C13_2 C14_2 1.369(6)
C13_2 H13_2 0.9300
C14_2 H14_2 0.9300
C15_2 C16_2 1.169(6)
C16_2 C27_2 1.449(6)
C27_2 C28_2 1.3900
C28_2 O32_2 1.360(5)
C28_2 C29_2 1.3900
O32_2 C35_2 1.369(8)
C35_2 H35A_2 0.9600
C35_2 H35B_2 0.9600
C35_2 H35C_2 0.9600
N17_2 C18_2 1.321(6)
N17_2 C22_2 1.324(6)
C18_2 C19_2 1.369(6)
C18_2 H18_2 0.9300
C19_2 C20_2 1.373(6)
C19_2 H19_2 0.9300
C20_2 C21_2 1.377(6)
C20_2 C23_2 1.450(7)
C21_2 C22_2 1.382(6)
C21_2 H21_2 0.9300
C22_2 H22_2 0.9300
C23_2 C24_2 1.174(6)
C24_2 C29_2 1.441(6)
C29_2 C30_2 1.3900
C30_2 O33_2 1.362(6)
O33_2 C36_2 1.361(8)
C36_2 H36A_2 0.9600
C36_2 H36B_2 0.9600
C36_2 H36C_2 0.9600
N1_3 C6_3 1.322(6)
N1_3 C2_3 1.328(6)
C2_3 C3_3 1.375(6)
C2_3 H2_3 0.9300
C3_3 C4_3 1.385(6)
C3_3 H3_3 0.9300
C4_3 C5_3 1.378(6)
C4_3 C7_3 1.436(6)
C5_3 C6_3 1.369(6)
C5_3 H5_3 0.9300
C6_3 H6_3 0.9300
C7_3 C8_3 1.172(6)
C8_3 C25_3 1.444(6)
C25_3 C26_3 1.3900
C25_3 C30_3 1.3900
C26_3 O31_3 1.370(5)
C26_3 C27_3 1.3900
O31_3 C34_3 1.386(8)
C34_3 H34A_3 0.9600
C34_3 H34B_3 0.9600
C34_3 H34C_3 0.9600
N9_3 C14_3 1.312(6)
N9_3 C10_3 1.316(6)
C10_3 C11_3 1.369(6)
C10_3 H10_3 0.9300
C11_3 C12_3 1.378(6)
C11_3 H11_3 0.9300
C12_3 C13_3 1.368(6)
C12_3 C15_3 1.453(6)
C13_3 C14_3 1.384(6)
C13_3 H13_3 0.9300
C14_3 H14_3 0.9300
C15_3 C16_3 1.167(6)
C16_3 C27_3 1.438(5)
C27_3 C28_3 1.3900
C28_3 O32_3 1.363(5)
C28_3 C29_3 1.3900
O32_3 C35_3 1.374(8)
C35_3 H35A_3 0.9600
C35_3 H35B_3 0.9600
C35_3 H35C_3 0.9600
N17_3 C18_3 1.326(6)
N17_3 C22_3 1.326(6)
C18_3 C19_3 1.361(6)
C18_3 H18_3 0.9300
C19_3 C20_3 1.372(6)
C19_3 H19_3 0.9300
C20_3 C21_3 1.373(6)
C20_3 C23_3 1.438(6)
C21_3 C22_3 1.362(6)
C21_3 H21_3 0.9300
C22_3 H22_3 0.9300
C23_3 C24_3 1.176(6)
C24_3 C29_3 1.446(6)
C29_3 C30_3 1.3900
C30_3 O33_3 1.350(5)
O33_3 C36_3 1.378(7)
C36_3 H36A_3 0.9600
C36_3 H36B_3 0.9600
C36_3 H36C_3 0.9600
N1_4 C6_4 1.316(6)
N1_4 C2_4 1.326(6)
C2_4 C3_4 1.368(6)
C2_4 H2_4 0.9300
C3_4 C4_4 1.371(6)
C3_4 H3_4 0.9300
C4_4 C5_4 1.371(6)
C4_4 C7_4 1.439(7)
C5_4 C6_4 1.366(6)
C5_4 H5_4 0.9300
C6_4 H6_4 0.9300
C7_4 C8_4 1.171(6)
C8_4 C25_4 1.445(6)
C25_4 C26_4 1.3900
C25_4 C30_4 1.3900
C26_4 O31_4 1.355(5)
C26_4 C27_4 1.3900
O31_4 C34_4 1.384(8)
C34_4 H34A_4 0.9600
C34_4 H34B_4 0.9600
C34_4 H34C_4 0.9600
N9_4 C14_4 1.312(6)
N9_4 C10_4 1.330(6)
C10_4 C11_4 1.372(6)
C10_4 H10_4 0.9300
C11_4 C12_4 1.370(6)
C11_4 H11_4 0.9300
C12_4 C13_4 1.375(6)
C12_4 C15_4 1.444(6)
C13_4 C14_4 1.372(6)
C13_4 H13_4 0.9300
C14_4 H14_4 0.9300
C15_4 C16_4 1.179(6)
C16_4 C27_4 1.444(6)
C27_4 C28_4 1.3900
C28_4 O32_4 1.371(5)
C28_4 C29_4 1.3900
O32_4 C35_4 1.381(9)
C35_4 H35A_4 0.9600
C35_4 H35B_4 0.9600
C35_4 H35C_4 0.9600
N17_4 C18_4 1.318(6)
N17_4 C22_4 1.320(6)
C18_4 C19_4 1.368(6)
C18_4 H18_4 0.9300
C19_4 C20_4 1.378(6)
C19_4 H19_4 0.9300
C20_4 C21_4 1.369(6)
C20_4 C23_4 1.447(6)
C21_4 C22_4 1.371(6)
C21_4 H21_4 0.9300
C22_4 H22_4 0.9300
C23_4 C24_4 1.166(6)
C24_4 C29_4 1.441(5)
C29_4 C30_4 1.3900
C30_4 O33_4 1.364(5)
O33_4 C36_4 1.363(8)
C36_4 H36A_4 0.9600
C36_4 H36B_4 0.9600
C36_4 H36C_4 0.9600
C1_5 C2_5 1.535(7)
C1_5 P1_5 1.819(6)
C1_5 H1A_5 0.9700
C1_5 H1B_5 0.9700
C2_5 C3_5 1.517(7)
C2_5 H2A_5 0.9700
C2_5 H2B_5 0.9700
C3_5 P2_5 1.820(6)
C3_5 H3A_5 0.9700
C3_5 H3B_5 0.9700
C4_5 C5_5 1.3900
C4_5 C9_5 1.3900
C4_5 P1_5 1.816(5)
C5_5 C6_5 1.3900
C5_5 H5_5 0.9300
C6_5 C7_5 1.3900
C6_5 H6_5 0.9300
C7_5 C8_5 1.3900
C7_5 H7_5 0.9300
C8_5 C9_5 1.3900
C8_5 H8_5 0.9300
C9_5 H9_5 0.9300
C10_5 C11_5 1.3900
C10_5 C15_5 1.3900
C10_5 P1_5 1.801(5)
C11_5 C12_5 1.3900
C11_5 H11_5 0.9300
C12_5 C13_5 1.3900
C12_5 H12_5 0.9300
C13_5 C14_5 1.3900
C13_5 H13_5 0.9300
C14_5 C15_5 1.3900
C14_5 H14_5 0.9300
C15_5 H15_5 0.9300
C16_5 C17_5 1.3900
C16_5 C21_5 1.3900
C16_5 P2_5 1.819(5)
C17_5 C18_5 1.3900
C17_5 H17_5 0.9300
C18_5 C19_5 1.3900
C18_5 H18_5 0.9300
C19_5 C20_5 1.3900
C19_5 H19_5 0.9300
C20_5 C21_5 1.3900
C20_5 H20_5 0.9300
C21_5 H21_5 0.9300
C22_5 C23_5 1.3900
C22_5 C27_5 1.3900
C22_5 P2_5 1.789(5)
C23_5 C24_5 1.3900
C23_5 H23_5 0.9300
C24_5 C25_5 1.3900
C24_5 H24_5 0.9300
C25_5 C26_5 1.3900
C25_5 H25_5 0.9300
C26_5 C27_5 1.3900
C26_5 H26_5 0.9300
C27_5 H27_5 0.9300
C1_6 C2_6 1.534(7)
C1_6 P1_6 1.810(6)
C1_6 H1A_6 0.9700
C1_6 H1B_6 0.9700
C2_6 C3_6 1.528(7)
C2_6 H2A_6 0.9700
C2_6 H2B_6 0.9700
C3_6 P2_6 1.819(6)
C3_6 H3A_6 0.9700
C3_6 H3B_6 0.9700
C4_6 C5_6 1.3900
C4_6 C9_6 1.3900
C4_6 P1_6 1.809(4)
C5_6 C6_6 1.3900
C5_6 H5_6 0.9300
C6_6 C7_6 1.3900
C6_6 H6_6 0.9300
C7_6 C8_6 1.3900
C7_6 H7_6 0.9300
C8_6 C9_6 1.3900
C8_6 H8_6 0.9300
C9_6 H9_6 0.9300
C10_6 C11_6 1.3900
C10_6 C15_6 1.3900
C10_6 P1_6 1.809(4)
C11_6 C12_6 1.3900
C11_6 H11_6 0.9300
C12_6 C13_6 1.3900
C12_6 H12_6 0.9300
C13_6 C14_6 1.3900
C13_6 H13_6 0.9300
C14_6 C15_6 1.3900
C14_6 H14_6 0.9300
C15_6 H15_6 0.9300
C16_6 C17_6 1.3900
C16_6 C21_6 1.3900
C16_6 P2_6 1.806(4)
C17_6 C18_6 1.3900
C17_6 H17_6 0.9300
C18_6 C19_6 1.3900
C18_6 H18_6 0.9300
C19_6 C20_6 1.3900
C19_6 H19_6 0.9300
C20_6 C21_6 1.3900
C20_6 H20_6 0.9300
C21_6 H21_6 0.9300
C22_6 C23_6 1.3900
C22_6 C27_6 1.3900
C22_6 P2_6 1.814(4)
C23_6 C24_6 1.3900
C23_6 H23_6 0.9300
C24_6 C25_6 1.3900
C24_6 H24_6 0.9300
C25_6 C26_6 1.3900
C25_6 H25_6 0.9300
C26_6 C27_6 1.3900
C26_6 H26_6 0.9300
C27_6 H27_6 0.9300
C1_7 C2_7 1.530(7)
C1_7 P1_7 1.800(6)
C1_7 H1A_7 0.9700
C1_7 H1B_7 0.9700
C2_7 C3_7 1.525(7)
C2_7 H2A_7 0.9700
C2_7 H2B_7 0.9700
C3_7 P2_7 1.821(5)
C3_7 H3A_7 0.9700
C3_7 H3B_7 0.9700
C4_7 C5_7 1.3900
C4_7 C9_7 1.3900
C4_7 P1_7 1.811(4)
C5_7 C6_7 1.3900
C5_7 H5_7 0.9300
C6_7 C7_7 1.3900
C6_7 H6_7 0.9300
C7_7 C8_7 1.3900
C7_7 H7_7 0.9300
C8_7 C9_7 1.3900
C8_7 H8_7 0.9300
C9_7 H9_7 0.9300
C10_7 C11_7 1.3900
C10_7 C15_7 1.3900
C10_7 P1_7 1.803(4)
C11_7 C12_7 1.3900
C11_7 H11_7 0.9300
C12_7 C13_7 1.3900
C12_7 H12_7 0.9300
C13_7 C14_7 1.3900
C13_7 H13_7 0.9300
C14_7 C15_7 1.3900
C14_7 H14_7 0.9300
C15_7 H15_7 0.9300
C16_7 C17_7 1.3900
C16_7 C21_7 1.3900
C16_7 P2_7 1.811(4)
C17_7 C18_7 1.3900
C17_7 H17_7 0.9300
C18_7 C19_7 1.3900
C18_7 H18_7 0.9300
C19_7 C20_7 1.3900
C19_7 H19_7 0.9300
C20_7 C21_7 1.3900
C20_7 H20_7 0.9300
C21_7 H21_7 0.9300
C22_7 C23_7 1.3900
C22_7 C27_7 1.3900
C22_7 P2_7 1.806(4)
C23_7 C24_7 1.3900
C23_7 H23_7 0.9300
C24_7 C25_7 1.3900
C24_7 H24_7 0.9300
C25_7 C26_7 1.3900
C25_7 H25_7 0.9300
C26_7 C27_7 1.3900
C26_7 H26_7 0.9300
C27_7 H27_7 0.9300
C1_8 C2_8 1.547(7)
C1_8 P1_8 1.813(6)
C1_8 H1A_8 0.9700
C1_8 H1B_8 0.9700
C2_8 C3_8 1.533(7)
C2_8 H2A_8 0.9700
C2_8 H2B_8 0.9700
C3_8 P2_8 1.813(6)
C3_8 H3A_8 0.9700
C3_8 H3B_8 0.9700
C4_8 C5_8 1.3900
C4_8 C9_8 1.3900
C4_8 P1_8 1.810(4)
C5_8 C6_8 1.3900
C5_8 H5_8 0.9300
C6_8 C7_8 1.3900
C6_8 H6_8 0.9300
C7_8 C8_8 1.3900
C7_8 H7_8 0.9300
C8_8 C9_8 1.3900
C8_8 H8_8 0.9300
C9_8 H9_8 0.9300
C10_8 C11_8 1.3900
C10_8 C15_8 1.3900
C10_8 P1_8 1.796(5)
C11_8 C12_8 1.3900
C11_8 H11_8 0.9300
C12_8 C13_8 1.3900
C12_8 H12_8 0.9300
C13_8 C14_8 1.3900
C13_8 H13_8 0.9300
C14_8 C15_8 1.3900
C14_8 H14_8 0.9300
C15_8 H15_8 0.9300
C16_8 C17_8 1.3900
C16_8 C21_8 1.3900
C16_8 P2_8 1.821(5)
C17_8 C18_8 1.3900
C17_8 H17_8 0.9300
C18_8 C19_8 1.3900
C18_8 H18_8 0.9300
C19_8 C20_8 1.3900
C19_8 H19_8 0.9300
C20_8 C21_8 1.3900
C20_8 H20_8 0.9300
C21_8 H21_8 0.9300
C22_8 C23_8 1.3900
C22_8 C27_8 1.3900
C22_8 P2_8 1.815(4)
C23_8 C24_8 1.3900
C23_8 H23_8 0.9300
C24_8 C25_8 1.3900
C24_8 H24_8 0.9300
C25_8 C26_8 1.3900
C25_8 H25_8 0.9300
C26_8 C27_8 1.3900
C26_8 H26_8 0.9300
C27_8 H27_8 0.9300
C1_9 C2_9 1.535(7)
C1_9 P1_9 1.808(6)
C1_9 H1A_9 0.9700
C1_9 H1B_9 0.9700
C2_9 C3_9 1.533(7)
C2_9 H2A_9 0.9700
C2_9 H2B_9 0.9700
C3_9 P2_9 1.809(6)
C3_9 H3A_9 0.9700
C3_9 H3B_9 0.9700
C4_9 C5_9 1.3900
C4_9 C9_9 1.3900
C4_9 P1_9 1.812(5)
C5_9 C6_9 1.3900
C5_9 H5_9 0.9300
C6_9 C7_9 1.3900
C6_9 H6_9 0.9300
C7_9 C8_9 1.3900
C7_9 H7_9 0.9300
C8_9 C9_9 1.3900
C8_9 H8_9 0.9300
C9_9 H9_9 0.9300
C10_9 C11_9 1.3900
C10_9 C15_9 1.3900
C10_9 P1_9 1.800(5)
C11_9 C12_9 1.3900
C11_9 H11_9 0.9300
C12_9 C13_9 1.3900
C12_9 H12_9 0.9300
C13_9 C14_9 1.3900
C13_9 H13_9 0.9300
C14_9 C15_9 1.3900
C14_9 H14_9 0.9300
C15_9 H15_9 0.9300
C16_9 C17_9 1.3900
C16_9 C21_9 1.3900
C16_9 P2_9 1.804(5)
C17_9 C18_9 1.3900
C17_9 H17_9 0.9300
C18_9 C19_9 1.3900
C18_9 H18_9 0.9300
C19_9 C20_9 1.3900
C19_9 H19_9 0.9300
C20_9 C21_9 1.3900
C20_9 H20_9 0.9300
C21_9 H21_9 0.9300
C22_9 C23_9 1.3900
C22_9 C27_9 1.3900
C22_9 P2_9 1.805(5)
C23_9 C24_9 1.3900
C23_9 H23_9 0.9300
C24_9 C25_9 1.3900
C24_9 H24_9 0.9300
C25_9 C26_9 1.3900
C25_9 H25_9 0.9300
C26_9 C27_9 1.3900
C26_9 H26_9 0.9300
C27_9 H27_9 0.9300
C1_10 C2_10 1.530(6)
C1_10 P1_10 1.811(6)
C1_10 H1A_10 0.9700
C1_10 H1B_10 0.9700
C2_10 C3_10 1.534(7)
C2_10 H2A_10 0.9700
C2_10 H2B_10 0.9700
C3_10 P2_10 1.827(6)
C3_10 H3A_10 0.9700
C3_10 H3B_10 0.9700
C4_10 C5_10 1.3900
C4_10 C9_10 1.3900
C4_10 P1_10 1.819(4)
C5_10 C6_10 1.3900
C5_10 H5_10 0.9300
C6_10 C7_10 1.3900
C6_10 H6_10 0.9300
C7_10 C8_10 1.3900
C7_10 H7_10 0.9300
C8_10 C9_10 1.3900
C8_10 H8_10 0.9300
C9_10 H9_10 0.9300
C10_10 C11_10 1.3900
C10_10 C15_10 1.3900
C10_10 P1_10 1.823(4)
C11_10 C12_10 1.3900
C11_10 H11_10 0.9300
C12_10 C13_10 1.3900
C12_10 H12_10 0.9300
C13_10 C14_10 1.3900
C13_10 H13_10 0.9300
C14_10 C15_10 1.3900
C14_10 H14_10 0.9300
C15_10 H15_10 0.9300
C16_10 C17_10 1.3900
C16_10 C21_10 1.3900
C16_10 P2_10 1.808(4)
C17_10 C18_10 1.3900
C17_10 H17_10 0.9300
C18_10 C19_10 1.3900
C18_10 H18_10 0.9300
C19_10 C20_10 1.3900
C19_10 H19_10 0.9300
C20_10 C21_10 1.3900
C20_10 H20_10 0.9300
C21_10 H21_10 0.9300
C22_10 C23_10 1.3900
C22_10 C27_10 1.3900
C22_10 P2_10 1.815(4)
C23_10 C24_10 1.3900
C23_10 H23_10 0.9300
C24_10 C25_10 1.3900
C24_10 H24_10 0.9300
C25_10 C26_10 1.3900
C25_10 H25_10 0.9300
C26_10 C27_10 1.3900
C26_10 H26_10 0.9300
C27_10 H27_10 0.9300
C1_11 F2_11 1.3306
C1_11 F3_11 1.3308
C1_11 F1_11 1.3354
C1_11 S1_11 1.8214
O1_11 S1_11 1.4457
O2_11 S1_11 1.4479
O3_11 S1_11 1.4287
C1_12 F2_12 1.3304
C1_12 F3_12 1.3306
C1_12 F1_12 1.3355
C1_12 S1_12 1.8216
O1_12 S1_12 1.4458
O2_12 S1_12 1.4479
O3_12 S1_12 1.4288
C1_13 F2_13 1.3306
C1_13 F3_13 1.3306
C1_13 F1_13 1.3354
C1_13 S1_13 1.8213
O1_13 S1_13 1.4458
O2_13 S1_13 1.4476
O3_13 S1_13 1.4289
C1_14 F3_14 1.3305
C1_14 F2_14 1.3306
C1_14 F1_14 1.3356
C1_14 S1_14 1.8216
O1_14 S1_14 1.4457
O2_14 S1_14 1.4479
O3_14 S1_14 1.4290
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
C6_1 N1_1 C2_1 C3_1 1.1(8)
Pt1 N1_1 C2_1 C3_1 179.6(4)
N1_1 C2_1 C3_1 C4_1 0.4(6)
C2_1 C3_1 C4_1 C5_1 -0.2(12)
C2_1 C3_1 C4_1 C7_1 179.7(8)
C3_1 C4_1 C5_1 C6_1 -1.5(16)
C7_1 C4_1 C5_1 C6_1 178.7(10)
C2_1 N1_1 C6_1 C5_1 -2.9(13)
Pt1 N1_1 C6_1 C5_1 178.7(8)
C4_1 C5_1 C6_1 N1_1 3.1(17)
C30_1 C25_1 C26_1 O31_1 -177.6(6)
C8_1 C25_1 C26_1 O31_1 0.2(7)
C30_1 C25_1 C26_1 C27_1 0.0
C8_1 C25_1 C26_1 C27_1 177.8(6)
C27_1 C26_1 O31_1 C34_1 37.0(19)
C25_1 C26_1 O31_1 C34_1 -145.4(17)
C14_1 N9_1 C10_1 C11_1 0.2(8)
Pt2 N9_1 C10_1 C11_1 169.5(4)
N9_1 C10_1 C11_1 C12_1 3.4(6)
C10_1 C11_1 C12_1 C13_1 -3.5(11)
C10_1 C11_1 C12_1 C15_1 179.9(7)
C11_1 C12_1 C13_1 C14_1 0.4(15)
C15_1 C12_1 C13_1 C14_1 176.9(10)
C10_1 N9_1 C14_1 C13_1 -3.6(13)
Pt2 N9_1 C14_1 C13_1 -173.1(8)
C12_1 C13_1 C14_1 N9_1 3.3(16)
O31_1 C26_1 C27_1 C28_1 177.6(6)
C25_1 C26_1 C27_1 C28_1 0.0
O31_1 C26_1 C27_1 C16_1 -4.2(7)
C25_1 C26_1 C27_1 C16_1 178.2(6)
C26_1 C27_1 C28_1 O32_1 178.8(5)
C16_1 C27_1 C28_1 O32_1 0.5(7)
C26_1 C27_1 C28_1 C29_1 0.0
C16_1 C27_1 C28_1 C29_1 -178.3(6)
C29_1 C28_1 O32_1 C35_1 -88.4(9)
C27_1 C28_1 O32_1 C35_1 92.8(9)
C22_1 N17_1 C18_1 C19_1 -0.2(8)
Pt3 N17_1 C18_1 C19_1 178.0(4)
N17_1 C18_1 C19_1 C20_1 2.7(6)
C18_1 C19_1 C20_1 C21_1 -3.7(11)
C18_1 C19_1 C20_1 C23_1 -178.5(6)
C19_1 C20_1 C21_1 C22_1 2.3(14)
C23_1 C20_1 C21_1 C22_1 177.2(9)
C18_1 N17_1 C22_1 C21_1 -1.3(13)
Pt3 N17_1 C22_1 C21_1 -179.4(8)
C20_1 C21_1 C22_1 N17_1 0.2(15)
O32_1 C28_1 C29_1 C30_1 -178.8(5)
C27_1 C28_1 C29_1 C30_1 0.0
O32_1 C28_1 C29_1 C24_1 0.9(7)
C27_1 C28_1 C29_1 C24_1 179.7(5)
C28_1 C29_1 C30_1 O33_1 176.3(6)
C24_1 C29_1 C30_1 O33_1 -3.4(7)
C28_1 C29_1 C30_1 C25_1 0.0
C24_1 C29_1 C30_1 C25_1 -179.7(6)
C26_1 C25_1 C30_1 O33_1 -176.3(6)
C8_1 C25_1 C30_1 O33_1 5.9(7)
C26_1 C25_1 C30_1 C29_1 0.0
C8_1 C25_1 C30_1 C29_1 -177.8(6)
C29_1 C30_1 O33_1 C36_1 90.6(14)
C25_1 C30_1 O33_1 C36_1 -93.1(14)
C6_2 N1_2 C2_2 C3_2 1.1(8)
Pt1 N1_2 C2_2 C3_2 171.6(4)
N1_2 C2_2 C3_2 C4_2 6.1(7)
C2_2 C3_2 C4_2 C5_2 -7.6(13)
C2_2 C3_2 C4_2 C7_2 -176.2(8)
C3_2 C4_2 C5_2 C6_2 2.7(17)
C7_2 C4_2 C5_2 C6_2 170.6(11)
C2_2 N1_2 C6_2 C5_2 -6.6(13)
Pt1 N1_2 C6_2 C5_2 -177.4(8)
C4_2 C5_2 C6_2 N1_2 4.8(18)
C30_2 C25_2 C26_2 O31_2 -176.7(7)
C8_2 C25_2 C26_2 O31_2 1.4(9)
C30_2 C25_2 C26_2 C27_2 0.0
C8_2 C25_2 C26_2 C27_2 178.1(7)
C25_2 C26_2 O31_2 C34_2 -75.7(18)
C27_2 C26_2 O31_2 C34_2 107.6(17)
C14_2 N9_2 C10_2 C11_2 -0.2(8)
Pt5 N9_2 C10_2 C11_2 176.1(4)
N9_2 C10_2 C11_2 C12_2 2.0(7)
C10_2 C11_2 C12_2 C13_2 -4.6(13)
C10_2 C11_2 C12_2 C15_2 179.5(8)
C11_2 C12_2 C13_2 C14_2 5.4(16)
C15_2 C12_2 C13_2 C14_2 -178.7(10)
C10_2 N9_2 C14_2 C13_2 1.1(13)
Pt5 N9_2 C14_2 C13_2 -175.4(8)
C12_2 C13_2 C14_2 N9_2 -3.7(16)
O31_2 C26_2 C27_2 C28_2 176.6(7)
C25_2 C26_2 C27_2 C28_2 0.0
O31_2 C26_2 C27_2 C16_2 -3.6(9)
C25_2 C26_2 C27_2 C16_2 179.8(7)
C26_2 C27_2 C28_2 O32_2 178.9(6)
C16_2 C27_2 C28_2 O32_2 -1.0(8)
C26_2 C27_2 C28_2 C29_2 0.0
C16_2 C27_2 C28_2 C29_2 -179.8(7)
C27_2 C28_2 O32_2 C35_2 79.4(15)
C29_2 C28_2 O32_2 C35_2 -101.8(14)
C22_2 N17_2 C18_2 C19_2 1.6(7)
Pt4 N17_2 C18_2 C19_2 173.1(4)
N17_2 C18_2 C19_2 C20_2 3.5(6)
C18_2 C19_2 C20_2 C21_2 -5.1(11)
C18_2 C19_2 C20_2 C23_2 -178.7(7)
C19_2 C20_2 C21_2 C22_2 1.9(14)
C23_2 C20_2 C21_2 C22_2 175.6(9)
C18_2 N17_2 C22_2 C21_2 -5.0(12)
Pt4 N17_2 C22_2 C21_2 -176.7(7)
C20_2 C21_2 C22_2 N17_2 3.3(15)
O32_2 C28_2 C29_2 C30_2 -178.9(6)
C27_2 C28_2 C29_2 C30_2 0.0
O32_2 C28_2 C29_2 C24_2 0.8(8)
C27_2 C28_2 C29_2 C24_2 179.6(6)
C28_2 C29_2 C30_2 O33_2 176.9(6)
C24_2 C29_2 C30_2 O33_2 -2.7(8)
C28_2 C29_2 C30_2 C25_2 0.0
C24_2 C29_2 C30_2 C25_2 -179.6(7)
C26_2 C25_2 C30_2 O33_2 -176.9(6)
C8_2 C25_2 C30_2 O33_2 5.0(9)
C26_2 C25_2 C30_2 C29_2 0.0
C8_2 C25_2 C30_2 C29_2 -178.0(7)
C29_2 C30_2 O33_2 C36_2 97.3(15)
C25_2 C30_2 O33_2 C36_2 -85.8(16)
C6_3 N1_3 C2_3 C3_3 -1.6(8)
Pt2 N1_3 C2_3 C3_3 178.6(4)
N1_3 C2_3 C3_3 C4_3 2.9(6)
C2_3 C3_3 C4_3 C5_3 -4.0(11)
C2_3 C3_3 C4_3 C7_3 -178.5(7)
C3_3 C4_3 C5_3 C6_3 4.2(15)
C7_3 C4_3 C5_3 C6_3 178.5(10)
C2_3 N1_3 C6_3 C5_3 1.7(14)
Pt2 N1_3 C6_3 C5_3 -178.4(8)
C4_3 C5_3 C6_3 N1_3 -3.1(16)
C30_3 C25_3 C26_3 O31_3 178.5(6)
C8_3 C25_3 C26_3 O31_3 -1.5(7)
C30_3 C25_3 C26_3 C27_3 0.0
C8_3 C25_3 C26_3 C27_3 180.0(6)
C27_3 C26_3 O31_3 C34_3 -92.0(13)
C25_3 C26_3 O31_3 C34_3 89.5(13)
C14_3 N9_3 C10_3 C11_3 -0.5(8)
Pt4 N9_3 C10_3 C11_3 179.8(4)
N9_3 C10_3 C11_3 C12_3 1.9(7)
C10_3 C11_3 C12_3 C13_3 -4.2(13)
C10_3 C11_3 C12_3 C15_3 -179.1(8)
C11_3 C12_3 C13_3 C14_3 5.1(17)
C15_3 C12_3 C13_3 C14_3 -180.0(10)
C10_3 N9_3 C14_3 C13_3 1.5(14)
Pt4 N9_3 C14_3 C13_3 -178.7(8)
C12_3 C13_3 C14_3 N9_3 -3.9(17)
O31_3 C26_3 C27_3 C28_3 -178.5(6)
C25_3 C26_3 C27_3 C28_3 0.0
O31_3 C26_3 C27_3 C16_3 0.9(8)
C25_3 C26_3 C27_3 C16_3 179.3(6)
C26_3 C27_3 C28_3 O32_3 178.1(6)
C16_3 C27_3 C28_3 O32_3 -1.3(7)
C26_3 C27_3 C28_3 C29_3 0.0
C16_3 C27_3 C28_3 C29_3 -179.3(6)
C29_3 C28_3 O32_3 C35_3 -90.2(14)
C27_3 C28_3 O32_3 C35_3 91.8(14)
C22_3 N17_3 C18_3 C19_3 -1.9(8)
Pt6 N17_3 C18_3 C19_3 173.3(4)
N17_3 C18_3 C19_3 C20_3 3.3(6)
C18_3 C19_3 C20_3 C21_3 -3.4(11)
C18_3 C19_3 C20_3 C23_3 -177.3(7)
C19_3 C20_3 C21_3 C22_3 2.3(16)
C23_3 C20_3 C21_3 C22_3 176.3(10)
C18_3 N17_3 C22_3 C21_3 0.7(13)
Pt6 N17_3 C22_3 C21_3 -174.5(8)
C20_3 C21_3 C22_3 N17_3 -1.1(17)
O32_3 C28_3 C29_3 C30_3 -178.0(6)
C27_3 C28_3 C29_3 C30_3 0.0
O32_3 C28_3 C29_3 C24_3 2.2(7)
C27_3 C28_3 C29_3 C24_3 -179.8(6)
C28_3 C29_3 C30_3 O33_3 176.5(5)
C24_3 C29_3 C30_3 O33_3 -3.7(7)
C28_3 C29_3 C30_3 C25_3 0.0
C24_3 C29_3 C30_3 C25_3 179.8(6)
C26_3 C25_3 C30_3 O33_3 -176.6(5)
C8_3 C25_3 C30_3 O33_3 3.4(7)
C26_3 C25_3 C30_3 C29_3 0.0
C8_3 C25_3 C30_3 C29_3 180.0(6)
C29_3 C30_3 O33_3 C36_3 85.4(9)
C25_3 C30_3 O33_3 C36_3 -98.1(9)
C6_4 N1_4 C2_4 C3_4 -4.5(8)
Pt3 N1_4 C2_4 C3_4 173.2(4)
N1_4 C2_4 C3_4 C4_4 5.1(6)
C2_4 C3_4 C4_4 C5_4 -5.2(11)
C2_4 C3_4 C4_4 C7_4 -178.3(7)
C3_4 C4_4 C5_4 C6_4 5.2(14)
C7_4 C4_4 C5_4 C6_4 178.3(9)
C2_4 N1_4 C6_4 C5_4 4.5(13)
Pt3 N1_4 C6_4 C5_4 -173.2(8)
C4_4 C5_4 C6_4 N1_4 -5.1(16)
C30_4 C25_4 C26_4 O31_4 178.1(5)
C8_4 C25_4 C26_4 O31_4 -1.9(7)
C30_4 C25_4 C26_4 C27_4 0.0
C8_4 C25_4 C26_4 C27_4 180.0(6)
C27_4 C26_4 O31_4 C34_4 -93.7(9)
C25_4 C26_4 O31_4 C34_4 88.2(9)
C14_4 N9_4 C10_4 C11_4 -1.6(8)
Pt6 N9_4 C10_4 C11_4 177.1(4)
N9_4 C10_4 C11_4 C12_4 3.7(6)
C10_4 C11_4 C12_4 C13_4 -4.2(11)
C10_4 C11_4 C12_4 C15_4 -178.7(7)
C11_4 C12_4 C13_4 C14_4 2.9(15)
C15_4 C12_4 C13_4 C14_4 177.4(10)
C10_4 N9_4 C14_4 C13_4 0.2(14)
Pt6 N9_4 C14_4 C13_4 -178.5(8)
C12_4 C13_4 C14_4 N9_4 -1.0(17)
O31_4 C26_4 C27_4 C28_4 -178.1(5)
C25_4 C26_4 C27_4 C28_4 0.0
O31_4 C26_4 C27_4 C16_4 0.5(7)
C25_4 C26_4 C27_4 C16_4 178.7(6)
C26_4 C27_4 C28_4 O32_4 176.0(6)
C16_4 C27_4 C28_4 O32_4 -2.7(8)
C26_4 C27_4 C28_4 C29_4 0.0
C16_4 C27_4 C28_4 C29_4 -178.7(6)
C29_4 C28_4 O32_4 C35_4 -90.7(15)
C27_4 C28_4 O32_4 C35_4 93.3(15)
C22_4 N17_4 C18_4 C19_4 -1.3(9)
Pt5 N17_4 C18_4 C19_4 176.9(4)
N17_4 C18_4 C19_4 C20_4 1.2(7)
C18_4 C19_4 C20_4 C21_4 -0.7(14)
C18_4 C19_4 C20_4 C23_4 -178.8(8)
C19_4 C20_4 C21_4 C22_4 0.3(18)
C23_4 C20_4 C21_4 C22_4 178.5(11)
C18_4 N17_4 C22_4 C21_4 0.8(15)
Pt5 N17_4 C22_4 C21_4 -177.4(9)
C20_4 C21_4 C22_4 N17_4 -0.3(19)
O32_4 C28_4 C29_4 C30_4 -176.0(6)
C27_4 C28_4 C29_4 C30_4 0.0
O32_4 C28_4 C29_4 C24_4 4.5(8)
C27_4 C28_4 C29_4 C24_4 -179.4(6)
C28_4 C29_4 C30_4 O33_4 -179.6(6)
C24_4 C29_4 C30_4 O33_4 -0.2(8)
C28_4 C29_4 C30_4 C25_4 0.0
C24_4 C29_4 C30_4 C25_4 179.4(6)
C26_4 C25_4 C30_4 O33_4 179.7(6)
C8_4 C25_4 C30_4 O33_4 -0.3(7)
C26_4 C25_4 C30_4 C29_4 0.0
C8_4 C25_4 C30_4 C29_4 -180.0(6)
C29_4 C30_4 O33_4 C36_4 70.2(14)
C25_4 C30_4 O33_4 C36_4 -109.4(13)
P1_5 C1_5 C2_5 C3_5 70.6(9)
C1_5 C2_5 C3_5 P2_5 -70.9(9)
C9_5 C4_5 C5_5 C6_5 0.0
P1_5 C4_5 C5_5 C6_5 179.1(5)
C4_5 C5_5 C6_5 C7_5 0.0
C5_5 C6_5 C7_5 C8_5 0.0
C6_5 C7_5 C8_5 C9_5 0.0
C7_5 C8_5 C9_5 C4_5 0.0
C5_5 C4_5 C9_5 C8_5 0.0
P1_5 C4_5 C9_5 C8_5 -179.1(5)
C15_5 C10_5 C11_5 C12_5 0.0
P1_5 C10_5 C11_5 C12_5 176.8(5)
C10_5 C11_5 C12_5 C13_5 0.0
C11_5 C12_5 C13_5 C14_5 0.0
C12_5 C13_5 C14_5 C15_5 0.0
C13_5 C14_5 C15_5 C10_5 0.0
C11_5 C10_5 C15_5 C14_5 0.0
P1_5 C10_5 C15_5 C14_5 -176.8(5)
C21_5 C16_5 C17_5 C18_5 0.0
P2_5 C16_5 C17_5 C18_5 -179.5(6)
C16_5 C17_5 C18_5 C19_5 0.0
C17_5 C18_5 C19_5 C20_5 0.0
C18_5 C19_5 C20_5 C21_5 0.0
C19_5 C20_5 C21_5 C16_5 0.0
C17_5 C16_5 C21_5 C20_5 0.0
P2_5 C16_5 C21_5 C20_5 179.5(6)
C27_5 C22_5 C23_5 C24_5 0.0
P2_5 C22_5 C23_5 C24_5 -177.9(6)
C22_5 C23_5 C24_5 C25_5 0.0
C23_5 C24_5 C25_5 C26_5 0.0
C24_5 C25_5 C26_5 C27_5 0.0
C25_5 C26_5 C27_5 C22_5 0.0
C23_5 C22_5 C27_5 C26_5 0.0
P2_5 C22_5 C27_5 C26_5 177.8(6)
C11_5 C10_5 P1_5 C4_5 154.1(5)
C15_5 C10_5 P1_5 C4_5 -29.1(5)
C11_5 C10_5 P1_5 C1_5 40.9(6)
C15_5 C10_5 P1_5 C1_5 -142.3(5)
C11_5 C10_5 P1_5 Pt1 -82.8(5)
C15_5 C10_5 P1_5 Pt1 94.0(4)
C5_5 C4_5 P1_5 C10_5 97.3(5)
C9_5 C4_5 P1_5 C10_5 -83.6(5)
C5_5 C4_5 P1_5 C1_5 -151.8(5)
C9_5 C4_5 P1_5 C1_5 27.2(6)
C5_5 C4_5 P1_5 Pt1 -24.7(5)
C9_5 C4_5 P1_5 Pt1 154.3(4)
C2_5 C1_5 P1_5 C10_5 177.1(6)
C2_5 C1_5 P1_5 C4_5 65.6(7)
C2_5 C1_5 P1_5 Pt1 -60.9(7)
C23_5 C22_5 P2_5 C16_5 -161.6(5)
C27_5 C22_5 P2_5 C16_5 20.5(6)
C23_5 C22_5 P2_5 C3_5 -50.3(6)
C27_5 C22_5 P2_5 C3_5 131.9(6)
C23_5 C22_5 P2_5 Pt1 74.5(5)
C27_5 C22_5 P2_5 Pt1 -103.3(5)
C17_5 C16_5 P2_5 C22_5 -101.3(6)
C21_5 C16_5 P2_5 C22_5 79.2(6)
C17_5 C16_5 P2_5 C3_5 149.3(5)
C21_5 C16_5 P2_5 C3_5 -30.2(6)
C17_5 C16_5 P2_5 Pt1 22.7(6)
C21_5 C16_5 P2_5 Pt1 -156.8(4)
C2_5 C3_5 P2_5 C22_5 -174.0(7)
C2_5 C3_5 P2_5 C16_5 -65.9(7)
C2_5 C3_5 P2_5 Pt1 60.9(7)
P1_6 C1_6 C2_6 C3_6 68.6(9)
C1_6 C2_6 C3_6 P2_6 -68.2(9)
C9_6 C4_6 C5_6 C6_6 0.0
P1_6 C4_6 C5_6 C6_6 -179.9(5)
C4_6 C5_6 C6_6 C7_6 0.0
C5_6 C6_6 C7_6 C8_6 0.0
C6_6 C7_6 C8_6 C9_6 0.0
C7_6 C8_6 C9_6 C4_6 0.0
C5_6 C4_6 C9_6 C8_6 0.0
P1_6 C4_6 C9_6 C8_6 179.9(5)
C15_6 C10_6 C11_6 C12_6 0.0
P1_6 C10_6 C11_6 C12_6 -179.6(5)
C10_6 C11_6 C12_6 C13_6 0.0
C11_6 C12_6 C13_6 C14_6 0.0
C12_6 C13_6 C14_6 C15_6 0.0
C13_6 C14_6 C15_6 C10_6 0.0
C11_6 C10_6 C15_6 C14_6 0.0
P1_6 C10_6 C15_6 C14_6 179.6(5)
C21_6 C16_6 C17_6 C18_6 0.0
P2_6 C16_6 C17_6 C18_6 -178.2(4)
C16_6 C17_6 C18_6 C19_6 0.0
C17_6 C18_6 C19_6 C20_6 0.0
C18_6 C19_6 C20_6 C21_6 0.0
C19_6 C20_6 C21_6 C16_6 0.0
C17_6 C16_6 C21_6 C20_6 0.0
P2_6 C16_6 C21_6 C20_6 178.2(4)
C27_6 C22_6 C23_6 C24_6 0.0
P2_6 C22_6 C23_6 C24_6 -178.9(4)
C22_6 C23_6 C24_6 C25_6 0.0
C23_6 C24_6 C25_6 C26_6 0.0
C24_6 C25_6 C26_6 C27_6 0.0
C25_6 C26_6 C27_6 C22_6 0.0
C23_6 C22_6 C27_6 C26_6 0.0
P2_6 C22_6 C27_6 C26_6 178.9(4)
C11_6 C10_6 P1_6 C4_6 146.8(4)
C15_6 C10_6 P1_6 C4_6 -32.8(5)
C11_6 C10_6 P1_6 C1_6 33.5(5)
C15_6 C10_6 P1_6 C1_6 -146.1(5)
C11_6 C10_6 P1_6 Pt2 -89.9(4)
C15_6 C10_6 P1_6 Pt2 90.5(4)
C5_6 C4_6 P1_6 C10_6 97.3(4)
C9_6 C4_6 P1_6 C10_6 -82.5(4)
C5_6 C4_6 P1_6 C1_6 -151.6(4)
C9_6 C4_6 P1_6 C1_6 28.5(5)
C5_6 C4_6 P1_6 Pt2 -25.2(4)
C9_6 C4_6 P1_6 Pt2 154.9(3)
C2_6 C1_6 P1_6 C10_6 175.8(6)
C2_6 C1_6 P1_6 C4_6 65.1(7)
C2_6 C1_6 P1_6 Pt2 -61.5(7)
C17_6 C16_6 P2_6 C22_6 -94.8(4)
C21_6 C16_6 P2_6 C22_6 87.0(4)
C17_6 C16_6 P2_6 C3_6 155.8(4)
C21_6 C16_6 P2_6 C3_6 -22.3(5)
C17_6 C16_6 P2_6 Pt2 29.1(4)
C21_6 C16_6 P2_6 Pt2 -149.1(3)
C23_6 C22_6 P2_6 C16_6 -167.0(4)
C27_6 C22_6 P2_6 C16_6 14.1(4)
C23_6 C22_6 P2_6 C3_6 -54.6(5)
C27_6 C22_6 P2_6 C3_6 126.5(4)
C23_6 C22_6 P2_6 Pt2 68.6(4)
C27_6 C22_6 P2_6 Pt2 -110.3(4)
C2_6 C3_6 P2_6 C16_6 -65.7(7)
C2_6 C3_6 P2_6 C22_6 -175.8(6)
C2_6 C3_6 P2_6 Pt2 61.3(7)
P1_7 C1_7 C2_7 C3_7 70.2(9)
C1_7 C2_7 C3_7 P2_7 -69.0(9)
C9_7 C4_7 C5_7 C6_7 0.0
P1_7 C4_7 C5_7 C6_7 -177.6(5)
C4_7 C5_7 C6_7 C7_7 0.0
C5_7 C6_7 C7_7 C8_7 0.0
C6_7 C7_7 C8_7 C9_7 0.0
C7_7 C8_7 C9_7 C4_7 0.0
C5_7 C4_7 C9_7 C8_7 0.0
P1_7 C4_7 C9_7 C8_7 177.6(4)
C15_7 C10_7 C11_7 C12_7 0.0
P1_7 C10_7 C11_7 C12_7 179.1(5)
C10_7 C11_7 C12_7 C13_7 0.0
C11_7 C12_7 C13_7 C14_7 0.0
C12_7 C13_7 C14_7 C15_7 0.0
C13_7 C14_7 C15_7 C10_7 0.0
C11_7 C10_7 C15_7 C14_7 0.0
P1_7 C10_7 C15_7 C14_7 -179.1(5)
C21_7 C16_7 C17_7 C18_7 0.0
P2_7 C16_7 C17_7 C18_7 179.1(4)
C16_7 C17_7 C18_7 C19_7 0.0
C17_7 C18_7 C19_7 C20_7 0.0
C18_7 C19_7 C20_7 C21_7 0.0
C19_7 C20_7 C21_7 C16_7 0.0
C17_7 C16_7 C21_7 C20_7 0.0
P2_7 C16_7 C21_7 C20_7 -179.1(4)
C27_7 C22_7 C23_7 C24_7 0.0
P2_7 C22_7 C23_7 C24_7 -177.3(4)
C22_7 C23_7 C24_7 C25_7 0.0
C23_7 C24_7 C25_7 C26_7 0.0
C24_7 C25_7 C26_7 C27_7 0.0
C25_7 C26_7 C27_7 C22_7 0.0
C23_7 C22_7 C27_7 C26_7 0.0
P2_7 C22_7 C27_7 C26_7 177.3(4)
C2_7 C1_7 P1_7 C10_7 175.1(6)
C2_7 C1_7 P1_7 C4_7 63.4(7)
C2_7 C1_7 P1_7 Pt3 -62.5(7)
C11_7 C10_7 P1_7 C1_7 30.2(5)
C15_7 C10_7 P1_7 C1_7 -150.7(5)
C11_7 C10_7 P1_7 C4_7 144.7(4)
C15_7 C10_7 P1_7 C4_7 -36.3(5)
C11_7 C10_7 P1_7 Pt3 -92.7(4)
C15_7 C10_7 P1_7 Pt3 86.4(4)
C5_7 C4_7 P1_7 C1_7 -151.9(4)
C9_7 C4_7 P1_7 C1_7 30.5(5)
C5_7 C4_7 P1_7 C10_7 96.0(4)
C9_7 C4_7 P1_7 C10_7 -81.6(4)
C5_7 C4_7 P1_7 Pt3 -26.1(4)
C9_7 C4_7 P1_7 Pt3 156.4(3)
C23_7 C22_7 P2_7 C16_7 -170.3(3)
C27_7 C22_7 P2_7 C16_7 12.4(4)
C23_7 C22_7 P2_7 C3_7 -57.3(5)
C27_7 C22_7 P2_7 C3_7 125.4(4)
C23_7 C22_7 P2_7 Pt3 66.1(4)
C27_7 C22_7 P2_7 Pt3 -111.2(3)
C17_7 C16_7 P2_7 C22_7 -93.8(4)
C21_7 C16_7 P2_7 C22_7 85.3(4)
C17_7 C16_7 P2_7 C3_7 156.0(4)
C21_7 C16_7 P2_7 C3_7 -24.9(5)
C17_7 C16_7 P2_7 Pt3 30.1(4)
C21_7 C16_7 P2_7 Pt3 -150.8(3)
C2_7 C3_7 P2_7 C22_7 -175.3(6)
C2_7 C3_7 P2_7 C16_7 -64.3(7)
C2_7 C3_7 P2_7 Pt3 61.3(7)
P1_8 C1_8 C2_8 C3_8 75.2(9)
C1_8 C2_8 C3_8 P2_8 -69.2(9)
C9_8 C4_8 C5_8 C6_8 0.0
P1_8 C4_8 C5_8 C6_8 179.3(4)
C4_8 C5_8 C6_8 C7_8 0.0
C5_8 C6_8 C7_8 C8_8 0.0
C6_8 C7_8 C8_8 C9_8 0.0
C7_8 C8_8 C9_8 C4_8 0.0
C5_8 C4_8 C9_8 C8_8 0.0
P1_8 C4_8 C9_8 C8_8 -179.3(4)
C15_8 C10_8 C11_8 C12_8 0.0
P1_8 C10_8 C11_8 C12_8 175.8(5)
C10_8 C11_8 C12_8 C13_8 0.0
C11_8 C12_8 C13_8 C14_8 0.0
C12_8 C13_8 C14_8 C15_8 0.0
C13_8 C14_8 C15_8 C10_8 0.0
C11_8 C10_8 C15_8 C14_8 0.0
P1_8 C10_8 C15_8 C14_8 -175.8(5)
C21_8 C16_8 C17_8 C18_8 0.0
P2_8 C16_8 C17_8 C18_8 177.9(5)
C16_8 C17_8 C18_8 C19_8 0.0
C17_8 C18_8 C19_8 C20_8 0.0
C18_8 C19_8 C20_8 C21_8 0.0
C19_8 C20_8 C21_8 C16_8 0.0
C17_8 C16_8 C21_8 C20_8 0.0
P2_8 C16_8 C21_8 C20_8 -177.9(5)
C27_8 C22_8 C23_8 C24_8 0.0
P2_8 C22_8 C23_8 C24_8 -175.1(5)
C22_8 C23_8 C24_8 C25_8 0.0
C23_8 C24_8 C25_8 C26_8 0.0
C24_8 C25_8 C26_8 C27_8 0.0
C25_8 C26_8 C27_8 C22_8 0.0
C23_8 C22_8 C27_8 C26_8 0.0
P2_8 C22_8 C27_8 C26_8 175.0(6)
C11_8 C10_8 P1_8 C4_8 143.2(4)
C15_8 C10_8 P1_8 C4_8 -41.0(5)
C11_8 C10_8 P1_8 C1_8 30.9(5)
C15_8 C10_8 P1_8 C1_8 -153.3(5)
C11_8 C10_8 P1_8 Pt4 -90.7(4)
C15_8 C10_8 P1_8 Pt4 85.1(4)
C5_8 C4_8 P1_8 C10_8 98.9(4)
C9_8 C4_8 P1_8 C10_8 -81.8(4)
C5_8 C4_8 P1_8 C1_8 -149.0(4)
C9_8 C4_8 P1_8 C1_8 30.4(5)
C5_8 C4_8 P1_8 Pt4 -24.4(4)
C9_8 C4_8 P1_8 Pt4 154.9(3)
C2_8 C1_8 P1_8 C10_8 171.1(6)
C2_8 C1_8 P1_8 C4_8 59.1(7)
C2_8 C1_8 P1_8 Pt4 -67.8(6)
C2_8 C3_8 P2_8 C22_8 -179.7(7)
C2_8 C3_8 P2_8 C16_8 -68.0(8)
C2_8 C3_8 P2_8 Pt4 57.5(8)
C23_8 C22_8 P2_8 C3_8 -48.8(6)
C27_8 C22_8 P2_8 C3_8 136.1(6)
C23_8 C22_8 P2_8 C16_8 -161.3(5)
C27_8 C22_8 P2_8 C16_8 23.6(6)
C23_8 C22_8 P2_8 Pt4 75.7(5)
C27_8 C22_8 P2_8 Pt4 -99.4(5)
C17_8 C16_8 P2_8 C3_8 159.7(4)
C21_8 C16_8 P2_8 C3_8 -22.4(5)
C17_8 C16_8 P2_8 C22_8 -90.6(4)
C21_8 C16_8 P2_8 C22_8 87.3(4)
C17_8 C16_8 P2_8 Pt4 32.5(4)
C21_8 C16_8 P2_8 Pt4 -149.5(3)
P1_9 C1_9 C2_9 C3_9 78.4(9)
C1_9 C2_9 C3_9 P2_9 -75.1(9)
C9_9 C4_9 C5_9 C6_9 0.0
P1_9 C4_9 C5_9 C6_9 -179.9(6)
C4_9 C5_9 C6_9 C7_9 0.0
C5_9 C6_9 C7_9 C8_9 0.0
C6_9 C7_9 C8_9 C9_9 0.0
C7_9 C8_9 C9_9 C4_9 0.0
C5_9 C4_9 C9_9 C8_9 0.0
P1_9 C4_9 C9_9 C8_9 179.9(6)
C15_9 C10_9 C11_9 C12_9 0.0
P1_9 C10_9 C11_9 C12_9 176.2(7)
C10_9 C11_9 C12_9 C13_9 0.0
C11_9 C12_9 C13_9 C14_9 0.0
C12_9 C13_9 C14_9 C15_9 0.0
C13_9 C14_9 C15_9 C10_9 0.0
C11_9 C10_9 C15_9 C14_9 0.0
P1_9 C10_9 C15_9 C14_9 -176.2(7)
C21_9 C16_9 C17_9 C18_9 0.0
P2_9 C16_9 C17_9 C18_9 178.0(6)
C16_9 C17_9 C18_9 C19_9 0.0
C17_9 C18_9 C19_9 C20_9 0.0
C18_9 C19_9 C20_9 C21_9 0.0
C19_9 C20_9 C21_9 C16_9 0.0
C17_9 C16_9 C21_9 C20_9 0.0
P2_9 C16_9 C21_9 C20_9 -177.9(6)
C27_9 C22_9 C23_9 C24_9 0.0
P2_9 C22_9 C23_9 C24_9 -179.2(5)
C22_9 C23_9 C24_9 C25_9 0.0
C23_9 C24_9 C25_9 C26_9 0.0
C24_9 C25_9 C26_9 C27_9 0.0
C25_9 C26_9 C27_9 C22_9 0.0
C23_9 C22_9 C27_9 C26_9 0.0
P2_9 C22_9 C27_9 C26_9 179.2(5)
C11_9 C10_9 P1_9 C1_9 39.5(7)
C15_9 C10_9 P1_9 C1_9 -144.3(6)
C11_9 C10_9 P1_9 C4_9 152.3(6)
C15_9 C10_9 P1_9 C4_9 -31.5(7)
C11_9 C10_9 P1_9 Pt5 -82.4(6)
C15_9 C10_9 P1_9 Pt5 93.8(5)
C2_9 C1_9 P1_9 C10_9 174.7(7)
C2_9 C1_9 P1_9 C4_9 62.2(8)
C2_9 C1_9 P1_9 Pt5 -63.6(8)
C5_9 C4_9 P1_9 C10_9 104.5(6)
C9_9 C4_9 P1_9 C10_9 -75.4(6)
C5_9 C4_9 P1_9 C1_9 -145.4(6)
C9_9 C4_9 P1_9 C1_9 34.7(6)
C5_9 C4_9 P1_9 Pt5 -20.1(6)
C9_9 C4_9 P1_9 Pt5 160.0(5)
C17_9 C16_9 P2_9 C22_9 -107.7(6)
C21_9 C16_9 P2_9 C22_9 70.2(6)
C17_9 C16_9 P2_9 C3_9 141.5(6)
C21_9 C16_9 P2_9 C3_9 -40.5(6)
C17_9 C16_9 P2_9 Pt5 14.3(6)
C21_9 C16_9 P2_9 Pt5 -167.8(4)
C23_9 C22_9 P2_9 C16_9 -145.0(5)
C27_9 C22_9 P2_9 C16_9 35.8(5)
C23_9 C22_9 P2_9 C3_9 -32.9(6)
C27_9 C22_9 P2_9 C3_9 147.9(5)
C23_9 C22_9 P2_9 Pt5 91.7(5)
C27_9 C22_9 P2_9 Pt5 -87.5(5)
C2_9 C3_9 P2_9 C16_9 -68.8(8)
C2_9 C3_9 P2_9 C22_9 -178.5(6)
C2_9 C3_9 P2_9 Pt5 58.2(8)
P1_10 C1_10 C2_10 C3_10 68.1(9)
C1_10 C2_10 C3_10 P2_10 -69.1(9)
C9_10 C4_10 C5_10 C6_10 0.0
P1_10 C4_10 C5_10 C6_10 178.3(4)
C4_10 C5_10 C6_10 C7_10 0.0
C5_10 C6_10 C7_10 C8_10 0.0
C6_10 C7_10 C8_10 C9_10 0.0
C7_10 C8_10 C9_10 C4_10 0.0
C5_10 C4_10 C9_10 C8_10 0.0
P1_10 C4_10 C9_10 C8_10 -178.3(4)
C15_10 C10_10 C11_10 C12_10 0.0
P1_10 C10_10 C11_10 C12_10 178.6(6)
C10_10 C11_10 C12_10 C13_10 0.0
C11_10 C12_10 C13_10 C14_10 0.0
C12_10 C13_10 C14_10 C15_10 0.0
C13_10 C14_10 C15_10 C10_10 0.0
C11_10 C10_10 C15_10 C14_10 0.0
P1_10 C10_10 C15_10 C14_10 -178.6(6)
C21_10 C16_10 C17_10 C18_10 0.0
P2_10 C16_10 C17_10 C18_10 179.4(4)
C16_10 C17_10 C18_10 C19_10 0.0
C17_10 C18_10 C19_10 C20_10 0.0
C18_10 C19_10 C20_10 C21_10 0.0
C19_10 C20_10 C21_10 C16_10 0.0
C17_10 C16_10 C21_10 C20_10 0.0
P2_10 C16_10 C21_10 C20_10 -179.4(4)
C27_10 C22_10 C23_10 C24_10 0.0
P2_10 C22_10 C23_10 C24_10 179.3(4)
C22_10 C23_10 C24_10 C25_10 0.0
C23_10 C24_10 C25_10 C26_10 0.0
C24_10 C25_10 C26_10 C27_10 0.0
C25_10 C26_10 C27_10 C22_10 0.0
C23_10 C22_10 C27_10 C26_10 0.0
P2_10 C22_10 C27_10 C26_10 -179.3(4)
C2_10 C1_10 P1_10 C4_10 65.9(7)
C2_10 C1_10 P1_10 C10_10 175.4(6)
C2_10 C1_10 P1_10 Pt6 -60.9(6)
C5_10 C4_10 P1_10 C1_10 -152.9(4)
C9_10 C4_10 P1_10 C1_10 25.4(5)
C5_10 C4_10 P1_10 C10_10 96.8(5)
C9_10 C4_10 P1_10 C10_10 -84.9(5)
C5_10 C4_10 P1_10 Pt6 -25.3(4)
C9_10 C4_10 P1_10 Pt6 153.0(3)
C11_10 C10_10 P1_10 C1_10 36.1(6)
C15_10 C10_10 P1_10 C1_10 -145.2(5)
C11_10 C10_10 P1_10 C4_10 149.4(5)
C15_10 C10_10 P1_10 C4_10 -31.9(5)
C11_10 C10_10 P1_10 Pt6 -88.4(5)
C15_10 C10_10 P1_10 Pt6 90.2(5)
C17_10 C16_10 P2_10 C22_10 -91.3(4)
C21_10 C16_10 P2_10 C22_10 88.1(4)
C17_10 C16_10 P2_10 C3_10 158.2(4)
C21_10 C16_10 P2_10 C3_10 -22.4(5)
C17_10 C16_10 P2_10 Pt6 32.0(4)
C21_10 C16_10 P2_10 Pt6 -148.6(3)
C23_10 C22_10 P2_10 C16_10 -165.6(4)
C27_10 C22_10 P2_10 C16_10 13.7(4)
C23_10 C22_10 P2_10 C3_10 -52.0(5)
C27_10 C22_10 P2_10 C3_10 127.3(5)
C23_10 C22_10 P2_10 Pt6 70.1(4)
C27_10 C22_10 P2_10 Pt6 -110.6(3)
C2_10 C3_10 P2_10 C16_10 -64.9(7)
C2_10 C3_10 P2_10 C22_10 -176.8(6)
C2_10 C3_10 P2_10 Pt6 61.6(7)
F2_11 C1_11 S1_11 O3_11 -57.3
F3_11 C1_11 S1_11 O3_11 -177.2
F1_11 C1_11 S1_11 O3_11 63.4
F2_11 C1_11 S1_11 O1_11 64.7
F3_11 C1_11 S1_11 O1_11 -55.3
F1_11 C1_11 S1_11 O1_11 -174.7
F2_11 C1_11 S1_11 O2_11 -176.9
F3_11 C1_11 S1_11 O2_11 63.2
F1_11 C1_11 S1_11 O2_11 -56.2
F2_12 C1_12 S1_12 O3_12 -57.3
F3_12 C1_12 S1_12 O3_12 -177.2
F1_12 C1_12 S1_12 O3_12 63.4
F2_12 C1_12 S1_12 O1_12 64.7
F3_12 C1_12 S1_12 O1_12 -55.3
F1_12 C1_12 S1_12 O1_12 -174.7
F2_12 C1_12 S1_12 O2_12 -176.9
F3_12 C1_12 S1_12 O2_12 63.2
F1_12 C1_12 S1_12 O2_12 -56.2
F2_13 C1_13 S1_13 O3_13 -57.2
F3_13 C1_13 S1_13 O3_13 -177.2
F1_13 C1_13 S1_13 O3_13 63.4
F2_13 C1_13 S1_13 O1_13 64.7
F3_13 C1_13 S1_13 O1_13 -55.3
F1_13 C1_13 S1_13 O1_13 -174.7
F2_13 C1_13 S1_13 O2_13 -176.9
F3_13 C1_13 S1_13 O2_13 63.2
F1_13 C1_13 S1_13 O2_13 -56.3
F3_14 C1_14 S1_14 O3_14 -177.2
F2_14 C1_14 S1_14 O3_14 -57.2
F1_14 C1_14 S1_14 O3_14 63.4
F3_14 C1_14 S1_14 O1_14 -55.3
F2_14 C1_14 S1_14 O1_14 64.7
F1_14 C1_14 S1_14 O1_14 -174.7
F3_14 C1_14 S1_14 O2_14 63.2
F2_14 C1_14 S1_14 O2_14 -176.9
F1_14 C1_14 S1_14 O2_14 -56.2
