#------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: svn://www.crystallography.net/cod/cif/2/01/69/2016927.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2016927
loop_
_publ_author_name
'Konitz, Antoni'
'Krautscheid, Harald'
'Pikies, Jerzy'
_publ_section_title
(Di-tert-butylmethylphosphane)(η²-di-tert-butylphosphanylphosphinidene)(triphenylphosphane)platinum(0)
_journal_coeditor_code           GG3157
_journal_issue                   1
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              m21
_journal_page_last               m23
_journal_paper_doi               10.1107/S0108270108037979
_journal_volume                  65
_journal_year                    2009
_chemical_formula_iupac          '[Pt (C8 H18 P2) (C9 H21 P1) (C18 H15 P1)]'
_chemical_formula_moiety         'C35 H54 P4 Pt'
_chemical_formula_sum            'C35 H54 P4 Pt'
_chemical_formula_weight         793.74
_chemical_name_systematic
;
(Di-tert-butylmethylphosphane)(η²-di-tert-
butylphosphanylphosphinidene)(triphenylphosphane)platinum(0)
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                90
_cell_angle_beta                 101.646(9)
_cell_angle_gamma                90
_cell_formula_units_Z            32
_cell_length_a                   29.924(2)
_cell_length_b                   29.928(2)
_cell_length_c                   33.233(3)
_cell_measurement_reflns_used    90443
_cell_measurement_temperature    120
_cell_measurement_theta_max      32.38
_cell_measurement_theta_min      2.06
_cell_volume                     29150(4)
_computing_cell_refinement       'CrysAlis RED (Oxford Diffraction, 2005)'
_computing_data_collection       'CrysAlis CCD (Oxford Diffraction, 2005)'
_computing_data_reduction        'CrysAlis RED (Oxford Diffraction, 2005)'
_computing_molecular_graphics    'ORTEPII (Johnson, 1976)'
_computing_publication_material  'PLATON (Spek, 2003)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      120
_diffrn_detector_area_resol_mean 8.1883
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type
'Kuma KM4 four-axis diffractometer with Sapphire2 CCD detector'
_diffrn_measurement_method       ω
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0258
_diffrn_reflns_av_sigmaI/netI    0.0254
_diffrn_reflns_limit_h_max       35
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_k_max       32
_diffrn_reflns_limit_k_min       -35
_diffrn_reflns_limit_l_max       35
_diffrn_reflns_limit_l_min       -39
_diffrn_reflns_number            74063
_diffrn_reflns_reduction_process
;
;
_diffrn_reflns_theta_full        25.05
_diffrn_reflns_theta_max         25.05
_diffrn_reflns_theta_min         2.31
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    4.048
_exptl_absorpt_correction_T_max  0.672
_exptl_absorpt_correction_T_min  0.414
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_process_details
;
(CrysAlis RED; Oxford Diffraction, 2006)
Analytical numeric absorption correction using a multifaceted crystal
model based on expressions derived by Clark & Reid (1995)
;
_exptl_crystal_colour            'dark red'
_exptl_crystal_density_diffrn    1.447
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             12864
_exptl_crystal_size_max          0.145
_exptl_crystal_size_mid          0.094
_exptl_crystal_size_min          0.051
_refine_diff_density_max         2.083
_refine_diff_density_min         -0.713
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.090
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1493
_refine_ls_number_reflns         25787
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.090
_refine_ls_R_factor_all          0.0374
_refine_ls_R_factor_gt           0.0262
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[σ²(Fo²)+(0.0381P)²+39.9739P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0650
_refine_ls_wR_factor_ref         0.0682
_reflns_number_gt                20921
_reflns_number_total             25787
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            gg3157.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               2016927
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 -x,y,1/2-z
3 -x,-y,-z
4 x,-y,1/2+z
5 1/2+x,1/2+y,z
6 1/2-x,1/2+y,1/2-z
7 1/2-x,1/2-y,-z
8 1/2+x,1/2-y,1/2+z
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_thermal_displace_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
Pt Pt1 0.479820(10) 0.151040(10) 0.371780(10) 0.01490(10) Uani . . 1.000
P P11 0.55423(3) 0.17625(3) 0.37667(3) 0.0173(3) Uani . . 1.000
P P12 0.50620(3) 0.22680(3) 0.36802(3) 0.0230(3) Uani . . 1.000
P P13 0.40328(3) 0.16987(3) 0.36674(3) 0.0175(3) Uani . . 1.000
P P14 0.47776(3) 0.07423(3) 0.37580(3) 0.0170(3) Uani . . 1.000
C C101 0.59644(12) 0.18023(12) 0.42842(11) 0.0223(11) Uani . . 1.000
C C102 0.56866(14) 0.17182(15) 0.46229(11) 0.0309(14) Uani . . 1.000
C C103 0.61520(14) 0.22812(13) 0.43335(13) 0.0322(12) Uani . . 1.000
C C104 0.63613(13) 0.14722(13) 0.43370(12) 0.0262(11) Uani . . 1.000
C C105 0.58410(12) 0.16379(12) 0.33261(11) 0.0200(11) Uani . . 1.000
C C106 0.54783(13) 0.16964(14) 0.29279(11) 0.0267(12) Uani . . 1.000
C C107 0.62350(13) 0.19647(13) 0.33206(12) 0.0254(12) Uani . . 1.000
C C108 0.60136(13) 0.11538(12) 0.33396(11) 0.0237(11) Uani . . 1.000
C C109 0.39214(13) 0.21288(12) 0.40597(12) 0.0241(11) Uani . . 1.000
C C110 0.34247(13) 0.21361(14) 0.41207(13) 0.0291(12) Uani . . 1.000
C C111 0.40490(15) 0.26024(13) 0.39446(15) 0.0371(16) Uani . . 1.000
C C112 0.42276(14) 0.20050(14) 0.44782(12) 0.0320(12) Uani . . 1.000
C C113 0.37314(13) 0.18682(13) 0.31255(11) 0.0242(12) Uani . . 1.000
C C114 0.40060(14) 0.22260(14) 0.29464(13) 0.0314(12) Uani . . 1.000
C C115 0.37125(14) 0.14436(14) 0.28639(12) 0.0301(12) Uani . . 1.000
C C116 0.32377(14) 0.20352(15) 0.30934(13) 0.0352(14) Uani . . 1.000
C C117 0.36680(12) 0.12333(12) 0.37789(12) 0.0227(11) Uani . . 1.000
C C118 0.46247(12) 0.05263(12) 0.42336(11) 0.0185(11) Uani . . 1.000
C C119 0.45770(12) 0.00686(13) 0.43065(12) 0.0238(12) Uani . . 1.000
C C120 0.44656(13) -0.00744(14) 0.46736(13) 0.0321(12) Uani . . 1.000
C C121 0.44147(13) 0.02341(16) 0.49731(13) 0.0350(14) Uani . . 1.000
C C122 0.44825(13) 0.06858(15) 0.49114(12) 0.0315(14) Uani . . 1.000
C C123 0.45847(12) 0.08307(13) 0.45428(11) 0.0239(12) Uani . . 1.000
C C124 0.53060(12) 0.04080(12) 0.37688(11) 0.0202(11) Uani . . 1.000
C C125 0.56629(13) 0.04740(12) 0.41098(12) 0.0250(12) Uani . . 1.000
C C126 0.60776(14) 0.02529(13) 0.41387(14) 0.0316(14) Uani . . 1.000
C C127 0.61416(14) -0.00395(13) 0.38259(14) 0.0335(14) Uani . . 1.000
C C128 0.57858(15) -0.01135(13) 0.34983(14) 0.0342(16) Uani . . 1.000
C C129 0.53700(14) 0.01067(12) 0.34696(13) 0.0281(12) Uani . . 1.000
C C130 0.43901(12) 0.04665(11) 0.33246(11) 0.0197(11) Uani . . 1.000
C C131 0.44688(14) 0.05577(12) 0.29273(11) 0.0260(11) Uani . . 1.000
C C132 0.42027(15) 0.03583(13) 0.25832(12) 0.0316(14) Uani . . 1.000
C C133 0.38492(15) 0.00722(13) 0.26238(13) 0.0332(12) Uani . . 1.000
C C134 0.37622(14) -0.00155(13) 0.30103(12) 0.0289(12) Uani . . 1.000
C C135 0.40311(12) 0.01781(12) 0.33605(11) 0.0218(11) Uani . . 1.000
Pt Pt2 0.074410(10) 0.240220(10) 0.372390(10) 0.01380(10) Uani . . 1.000
P P21 0.00227(3) 0.21384(3) 0.37681(3) 0.0155(3) Uani . . 1.000
P P22 0.04682(3) 0.16437(3) 0.36638(3) 0.0205(3) Uani . . 1.000
P P23 0.14899(3) 0.22206(3) 0.36770(3) 0.0166(3) Uani . . 1.000
P P24 0.07696(3) 0.31701(3) 0.37628(3) 0.0158(3) Uani . . 1.000
C C201 -0.01577(13) 0.20777(12) 0.42880(11) 0.0217(11) Uani . . 1.000
C C202 0.02758(14) 0.21422(15) 0.46217(11) 0.0305(11) Uani . . 1.000
C C203 -0.03325(14) 0.15947(12) 0.43224(12) 0.0279(12) Uani . . 1.000
C C204 -0.05243(14) 0.24097(12) 0.43623(12) 0.0261(12) Uani . . 1.000
C C205 -0.04808(12) 0.22704(12) 0.33367(10) 0.0191(11) Uani . . 1.000
C C206 -0.03047(13) 0.22242(14) 0.29329(11) 0.0263(11) Uani . . 1.000
C C207 -0.08732(12) 0.19388(13) 0.33336(12) 0.0248(12) Uani . . 1.000
C C208 -0.06466(13) 0.27544(12) 0.33648(11) 0.0246(11) Uani . . 1.000
C C209 0.17761(12) 0.17922(12) 0.40765(12) 0.0235(12) Uani . . 1.000
C C210 0.23016(13) 0.18028(14) 0.41581(13) 0.0312(12) Uani . . 1.000
C C211 0.16144(14) 0.13156(13) 0.39525(14) 0.0339(14) Uani . . 1.000
C C212 0.16349(14) 0.19046(14) 0.44894(12) 0.0319(12) Uani . . 1.000
C C213 0.15604(12) 0.20483(13) 0.31402(11) 0.0225(11) Uani . . 1.000
C C214 0.12112(14) 0.16870(13) 0.29520(12) 0.0281(12) Uani . . 1.000
C C215 0.14620(14) 0.24728(13) 0.28716(12) 0.0286(12) Uani . . 1.000
C C216 0.20430(14) 0.18807(16) 0.31175(13) 0.0366(14) Uani . . 1.000
C C217 0.18994(13) 0.26842(12) 0.37834(12) 0.0233(11) Uani . . 1.000
C C218 0.11441(12) 0.34146(11) 0.42191(10) 0.0166(10) Uani . . 1.000
C C219 0.11869(12) 0.38784(12) 0.42797(11) 0.0209(11) Uani . . 1.000
C C220 0.14629(13) 0.40472(13) 0.46339(11) 0.0250(12) Uani . . 1.000
C C221 0.16982(13) 0.37599(13) 0.49337(11) 0.0251(11) Uani . . 1.000
C C222 0.16527(13) 0.33027(13) 0.48792(11) 0.0258(11) Uani . . 1.000
C C223 0.13759(12) 0.31328(12) 0.45264(11) 0.0207(11) Uani . . 1.000
C C224 0.02487(12) 0.34916(11) 0.38010(12) 0.0212(11) Uani . . 1.000
C C225 0.00679(13) 0.34326(13) 0.41533(13) 0.0268(12) Uani . . 1.000
C C226 -0.03245(14) 0.36531(13) 0.42029(14) 0.0328(14) Uani . . 1.000
C C227 -0.05508(14) 0.39342(13) 0.38940(15) 0.0348(14) Uani . . 1.000
C C228 -0.03693(14) 0.40101(13) 0.35485(14) 0.0339(14) Uani . . 1.000
C C229 0.00308(13) 0.37906(12) 0.34999(12) 0.0254(12) Uani . . 1.000
C C230 0.09421(12) 0.34401(11) 0.33174(11) 0.0190(11) Uani . . 1.000
C C231 0.06764(13) 0.33401(12) 0.29272(11) 0.0237(11) Uani . . 1.000
C C232 0.07810(15) 0.35287(13) 0.25733(12) 0.0300(14) Uani . . 1.000
C C233 0.11532(15) 0.38108(13) 0.26007(12) 0.0312(14) Uani . . 1.000
C C234 0.14204(14) 0.39081(13) 0.29834(12) 0.0259(12) Uani . . 1.000
C C235 0.13147(12) 0.37252(12) 0.33396(12) 0.0213(11) Uani . . 1.000
Pt Pt3 0.179720(10) -0.008290(10) 0.130090(10) 0.01490(10) Uani . . 1.000
P P31 0.20405(3) -0.08164(3) 0.12523(3) 0.0173(3) Uani . . 1.000
P P32 0.25638(3) -0.03538(3) 0.13470(3) 0.0236(3) Uani . . 1.000
P P33 0.19943(3) 0.06723(3) 0.13525(3) 0.0175(3) Uani . . 1.000
P P34 0.10196(3) -0.00536(3) 0.12539(3) 0.0168(3) Uani . . 1.000
C C301 0.19724(14) -0.11166(12) 0.07335(11) 0.0243(11) Uani . . 1.000
C C302 0.18168(15) -0.07663(13) 0.03956(12) 0.0304(14) Uani . . 1.000
C C303 0.24382(14) -0.12944(14) 0.06857(13) 0.0327(14) Uani . . 1.000
C C304 0.16270(14) -0.15054(13) 0.06742(12) 0.0271(12) Uani . . 1.000
C C305 0.20086(12) -0.12158(12) 0.16920(11) 0.0197(11) Uani . . 1.000
C C306 0.21517(14) -0.09449(13) 0.20924(11) 0.0264(12) Uani . . 1.000
C C307 0.23404(13) -0.16090(12) 0.16986(12) 0.0249(11) Uani . . 1.000
C C308 0.15226(13) -0.13873(13) 0.16718(12) 0.0242(12) Uani . . 1.000
C C309 0.23418(13) 0.08696(12) 0.09646(12) 0.0241(11) Uani . . 1.000
C C310 0.23328(14) 0.13820(12) 0.09030(13) 0.0276(12) Uani . . 1.000
C C311 0.28432(14) 0.07195(14) 0.10907(15) 0.0369(14) Uani . . 1.000
C C312 0.21313(14) 0.06565(13) 0.05459(12) 0.0307(12) Uani . . 1.000
C C313 0.22785(13) 0.08565(12) 0.18959(12) 0.0245(11) Uani . . 1.000
C C314 0.26745(14) 0.05421(14) 0.20828(12) 0.0303(12) Uani . . 1.000
C C315 0.19096(14) 0.08191(14) 0.21546(12) 0.0310(12) Uani . . 1.000
C C316 0.24584(16) 0.13388(14) 0.19280(14) 0.0380(16) Uani . . 1.000
C C317 0.15066(13) 0.10569(12) 0.12355(12) 0.0228(11) Uani . . 1.000
C C318 0.06975(12) 0.02063(11) 0.07795(10) 0.0192(11) Uani . . 1.000
C C319 0.02250(13) 0.02708(12) 0.07030(12) 0.0235(11) Uani . . 1.000
C C320 0.00008(14) 0.04612(13) 0.03336(12) 0.0311(12) Uani . . 1.000
C C321 0.02428(15) 0.05768(13) 0.00357(12) 0.0329(14) Uani . . 1.000
C C322 0.07089(15) 0.04978(13) 0.01001(12) 0.0315(14) Uani . . 1.000
C C323 0.09356(14) 0.03142(12) 0.04688(11) 0.0238(11) Uani . . 1.000
C C324 0.06828(12) -0.05790(12) 0.12340(11) 0.0205(11) Uani . . 1.000
C C325 0.06745(13) -0.08581(12) 0.08944(12) 0.0237(11) Uani . . 1.000
C C326 0.04452(13) -0.12666(13) 0.08629(13) 0.0304(12) Uani . . 1.000
C C327 0.02213(13) -0.13989(14) 0.11736(14) 0.0338(14) Uani . . 1.000
C C328 0.02131(13) -0.11216(14) 0.14981(14) 0.0331(14) Uani . . 1.000
C C329 0.04406(13) -0.07108(13) 0.15329(12) 0.0260(12) Uani . . 1.000
C C330 0.08357(12) 0.02345(12) 0.16855(11) 0.0193(11) Uani . . 1.000
C C331 0.10170(13) 0.00633(13) 0.20822(12) 0.0252(11) Uani . . 1.000
C C332 0.08961(13) 0.02511(15) 0.24302(12) 0.0312(14) Uani . . 1.000
C C333 0.06048(14) 0.06181(15) 0.23915(13) 0.0328(14) Uani . . 1.000
C C334 0.04274(13) 0.07943(13) 0.20024(12) 0.0286(12) Uani . . 1.000
C C335 0.05439(12) 0.06045(12) 0.16495(12) 0.0218(11) Uani . . 1.000
Pt Pt4 0.268410(10) 0.397220(10) 0.126030(10) 0.01380(10) Uani . . 1.000
P P41 0.24096(3) 0.47031(3) 0.12115(3) 0.0160(3) Uani . . 1.000
P P42 0.19370(3) 0.42344(3) 0.13132(3) 0.0206(3) Uani . . 1.000
P P43 0.25126(3) 0.32163(3) 0.13101(3) 0.0166(3) Uani . . 1.000
P P44 0.34439(3) 0.39555(3) 0.12251(3) 0.0161(3) Uani . . 1.000
C C401 0.22374(13) 0.49983(12) 0.06903(11) 0.0212(11) Uani . . 1.000
C C402 0.22299(15) 0.46380(14) 0.03563(11) 0.0306(11) Uani . . 1.000
C C403 0.17496(13) 0.51785(14) 0.06532(12) 0.0288(12) Uani . . 1.000
C C404 0.25553(13) 0.53798(13) 0.06171(12) 0.0279(12) Uani . . 1.000
C C405 0.26353(12) 0.51107(12) 0.16436(11) 0.0196(11) Uani . . 1.000
C C406 0.26767(14) 0.48441(13) 0.20484(11) 0.0268(11) Uani . . 1.000
C C407 0.31128(13) 0.52827(13) 0.16192(12) 0.0250(12) Uani . . 1.000
C C408 0.23075(13) 0.55073(12) 0.16442(12) 0.0252(12) Uani . . 1.000
C C409 0.19976(13) 0.30180(12) 0.09093(11) 0.0226(11) Uani . . 1.000
C C410 0.19914(14) 0.25095(13) 0.08318(13) 0.0321(12) Uani . . 1.000
C C411 0.15487(13) 0.31523(13) 0.10289(14) 0.0322(14) Uani . . 1.000
C C412 0.20209(14) 0.32469(14) 0.04983(12) 0.0304(12) Uani . . 1.000
C C413 0.24576(13) 0.30286(12) 0.18474(11) 0.0215(11) Uani . . 1.000
C C414 0.21351(14) 0.33384(13) 0.20289(12) 0.0282(12) Uani . . 1.000
C C415 0.29386(14) 0.30720(14) 0.21176(12) 0.0303(12) Uani . . 1.000
C C416 0.22988(16) 0.25438(13) 0.18718(13) 0.0351(14) Uani . . 1.000
C C417 0.29570(12) 0.28310(12) 0.12041(12) 0.0222(11) Uani . . 1.000
C C418 0.35891(12) 0.36827(11) 0.07668(10) 0.0170(10) Uani . . 1.000
C C419 0.40374(12) 0.36540(12) 0.07074(11) 0.0207(11) Uani . . 1.000
C C420 0.41286(13) 0.34576(12) 0.03538(11) 0.0240(12) Uani . . 1.000
C C421 0.37741(14) 0.32932(13) 0.00536(11) 0.0259(11) Uani . . 1.000
C C422 0.33286(14) 0.33280(13) 0.01062(11) 0.0256(11) Uani . . 1.000
C C423 0.32342(13) 0.35252(12) 0.04607(11) 0.0212(11) Uani . . 1.000
C C424 0.37616(12) 0.44855(12) 0.11934(12) 0.0210(11) Uani . . 1.000
C C425 0.36237(13) 0.47430(13) 0.08354(12) 0.0267(12) Uani . . 1.000
C C426 0.38345(14) 0.51509(13) 0.07906(14) 0.0342(14) Uani . . 1.000
C C427 0.41808(14) 0.53090(14) 0.11024(15) 0.0361(14) Uani . . 1.000
C C428 0.43273(14) 0.50517(14) 0.14483(14) 0.0350(14) Uani . . 1.000
C C429 0.41227(13) 0.46382(13) 0.14949(12) 0.0271(12) Uani . . 1.000
C C430 0.38145(12) 0.36846(12) 0.16701(10) 0.0179(10) Uani . . 1.000
C C431 0.37998(13) 0.38595(13) 0.20609(11) 0.0244(11) Uani . . 1.000
C C432 0.40691(14) 0.36809(15) 0.24160(12) 0.0317(14) Uani . . 1.000
C C433 0.43458(13) 0.33134(15) 0.23855(12) 0.0320(14) Uani . . 1.000
C C434 0.43586(13) 0.31308(13) 0.20056(12) 0.0275(12) Uani . . 1.000
C C435 0.40931(12) 0.33162(12) 0.16472(11) 0.0204(11) Uani . . 1.000
H H10A 0.55470 0.14210 0.45860 0.0460 Uiso calc R 1.000
H H10B 0.54470 0.19450 0.46040 0.0460 Uiso calc R 1.000
H H10C 0.58900 0.17360 0.48930 0.0460 Uiso calc R 1.000
H H10D 0.58980 0.24930 0.43030 0.0490 Uiso calc R 1.000
H H10E 0.63310 0.23400 0.41230 0.0490 Uiso calc R 1.000
H H10F 0.63470 0.23160 0.46070 0.0490 Uiso calc R 1.000
H H10G 0.62420 0.11660 0.43070 0.0390 Uiso calc R 1.000
H H10H 0.65550 0.15090 0.46100 0.0390 Uiso calc R 1.000
H H10I 0.65420 0.15290 0.41270 0.0390 Uiso calc R 1.000
H H10J 0.52190 0.14980 0.29350 0.0400 Uiso calc R 1.000
H H10K 0.56120 0.16210 0.26910 0.0400 Uiso calc R 1.000
H H10L 0.53730 0.20070 0.29050 0.0400 Uiso calc R 1.000
H H10M 0.61240 0.22720 0.33260 0.0380 Uiso calc R 1.000
H H10N 0.63550 0.19180 0.30710 0.0380 Uiso calc R 1.000
H H10O 0.64780 0.19130 0.35620 0.0380 Uiso calc R 1.000
H H10P 0.57570 0.09490 0.33320 0.0360 Uiso calc R 1.000
H H10Q 0.62400 0.11060 0.35930 0.0360 Uiso calc R 1.000
H H10R 0.61540 0.10980 0.31020 0.0360 Uiso calc R 1.000
H H11A 0.32220 0.22260 0.38640 0.0430 Uiso calc R 1.000
H H11B 0.33970 0.23490 0.43380 0.0430 Uiso calc R 1.000
H H11C 0.33390 0.18370 0.41990 0.0430 Uiso calc R 1.000
H H11D 0.38420 0.26970 0.36920 0.0560 Uiso calc R 1.000
H H11E 0.43630 0.26030 0.39020 0.0560 Uiso calc R 1.000
H H11F 0.40230 0.28090 0.41670 0.0560 Uiso calc R 1.000
H H11G 0.41370 0.17120 0.45670 0.0480 Uiso calc R 1.000
H H11H 0.41930 0.22310 0.46830 0.0480 Uiso calc R 1.000
H H11I 0.45470 0.19930 0.44500 0.0480 Uiso calc R 1.000
H H11J 0.40050 0.25050 0.31000 0.0470 Uiso calc R 1.000
H H11K 0.38670 0.22770 0.26570 0.0470 Uiso calc R 1.000
H H11L 0.43210 0.21230 0.29680 0.0470 Uiso calc R 1.000
H H11M 0.35170 0.12220 0.29600 0.0450 Uiso calc R 1.000
H H11N 0.40210 0.13210 0.28890 0.0450 Uiso calc R 1.000
H H11O 0.35880 0.15160 0.25760 0.0450 Uiso calc R 1.000
H H11P 0.30690 0.18230 0.32310 0.0530 Uiso calc R 1.000
H H11Q 0.30880 0.20600 0.28030 0.0530 Uiso calc R 1.000
H H11R 0.32420 0.23290 0.32250 0.0530 Uiso calc R 1.000
H H11S 0.37360 0.11710 0.40740 0.0340 Uiso calc R 1.000
H H11T 0.37290 0.09660 0.36290 0.0340 Uiso calc R 1.000
H H11U 0.33460 0.13170 0.36930 0.0340 Uiso calc R 1.000
H H119 0.46210 -0.01440 0.41060 0.0360 Uiso calc R 1.000
H H120 0.44240 -0.03840 0.47190 0.0480 Uiso calc R 1.000
H H121 0.43330 0.01360 0.52210 0.0530 Uiso calc R 1.000
H H122 0.44590 0.08960 0.51210 0.0380 Uiso calc R 1.000
H H123 0.46280 0.11400 0.45010 0.0290 Uiso calc R 1.000
H H125 0.56210 0.06720 0.43230 0.0300 Uiso calc R 1.000
H H126 0.63170 0.03000 0.43700 0.0380 Uiso calc R 1.000
H H127 0.64270 -0.01850 0.38400 0.0400 Uiso calc R 1.000
H H128 0.58240 -0.03180 0.32890 0.0410 Uiso calc R 1.000
H H129 0.51280 0.00490 0.32420 0.0340 Uiso calc R 1.000
H H131 0.47060 0.07570 0.28950 0.0310 Uiso calc R 1.000
H H132 0.42630 0.04180 0.23180 0.0380 Uiso calc R 1.000
H H133 0.36680 -0.00630 0.23880 0.0390 Uiso calc R 1.000
H H134 0.35180 -0.02080 0.30380 0.0340 Uiso calc R 1.000
H H135 0.39700 0.01140 0.36240 0.0260 Uiso calc R 1.000
H H20A 0.05040 0.19200 0.45850 0.0460 Uiso calc R 1.000
H H20B 0.02010 0.21050 0.48930 0.0460 Uiso calc R 1.000
H H20C 0.03980 0.24430 0.45990 0.0460 Uiso calc R 1.000
H H20D -0.01000 0.13820 0.42730 0.0420 Uiso calc R 1.000
H H20E -0.06140 0.15490 0.41170 0.0420 Uiso calc R 1.000
H H20F -0.03940 0.15470 0.45980 0.0420 Uiso calc R 1.000
H H20G -0.04300 0.27150 0.43120 0.0390 Uiso calc R 1.000
H H20H -0.05630 0.23840 0.46470 0.0390 Uiso calc R 1.000
H H20I -0.08140 0.23420 0.41760 0.0390 Uiso calc R 1.000
H H20J -0.02070 0.19160 0.29030 0.0390 Uiso calc R 1.000
H H20K -0.00460 0.24260 0.29390 0.0390 Uiso calc R 1.000
H H20L -0.05500 0.23020 0.27000 0.0390 Uiso calc R 1.000
H H20M -0.07590 0.16330 0.33260 0.0370 Uiso calc R 1.000
H H20N -0.11140 0.19920 0.30910 0.0370 Uiso calc R 1.000
H H20O -0.09970 0.19800 0.35820 0.0370 Uiso calc R 1.000
H H20P -0.03950 0.29610 0.33550 0.0370 Uiso calc R 1.000
H H20Q -0.07510 0.27950 0.36230 0.0370 Uiso calc R 1.000
H H20R -0.08990 0.28150 0.31330 0.0370 Uiso calc R 1.000
H H21A 0.24050 0.17260 0.39050 0.0470 Uiso calc R 1.000
H H21B 0.24240 0.15860 0.43730 0.0470 Uiso calc R 1.000
H H21C 0.24090 0.21030 0.42480 0.0470 Uiso calc R 1.000
H H21D 0.12800 0.13050 0.38980 0.0510 Uiso calc R 1.000
H H21E 0.17380 0.11090 0.41760 0.0510 Uiso calc R 1.000
H H21F 0.17220 0.12290 0.37040 0.0510 Uiso calc R 1.000
H H21G 0.13010 0.19130 0.44480 0.0470 Uiso calc R 1.000
H H21H 0.17600 0.21970 0.45870 0.0470 Uiso calc R 1.000
H H21I 0.17540 0.16750 0.46930 0.0470 Uiso calc R 1.000
H H21J 0.12700 0.14120 0.31140 0.0420 Uiso calc R 1.000
H H21K 0.12400 0.16270 0.26690 0.0420 Uiso calc R 1.000
H H21L 0.09020 0.17930 0.29540 0.0420 Uiso calc R 1.000
H H21M 0.17010 0.26950 0.29650 0.0430 Uiso calc R 1.000
H H21N 0.11650 0.25960 0.28950 0.0430 Uiso calc R 1.000
H H21O 0.14580 0.23960 0.25840 0.0430 Uiso calc R 1.000
H H21P 0.22700 0.21010 0.32460 0.0550 Uiso calc R 1.000
H H21Q 0.20640 0.18400 0.28290 0.0550 Uiso calc R 1.000
H H21R 0.21010 0.15950 0.32630 0.0550 Uiso calc R 1.000
H H21S 0.17700 0.29500 0.36310 0.0350 Uiso calc R 1.000
H H21T 0.21830 0.26000 0.36980 0.0350 Uiso calc R 1.000
H H21U 0.19640 0.27500 0.40780 0.0350 Uiso calc R 1.000
H H219 0.10270 0.40770 0.40780 0.0250 Uiso calc R 1.000
H H220 0.14920 0.43610 0.46720 0.0300 Uiso calc R 1.000
H H221 0.18890 0.38770 0.51740 0.0300 Uiso calc R 1.000
H H222 0.18110 0.31050 0.50830 0.0310 Uiso calc R 1.000
H H223 0.13430 0.28180 0.44930 0.0250 Uiso calc R 1.000
H H225 0.02170 0.32370 0.43630 0.0320 Uiso calc R 1.000
H H226 -0.04390 0.36130 0.44470 0.0390 Uiso calc R 1.000
H H227 -0.08290 0.40730 0.39200 0.0420 Uiso calc R 1.000
H H228 -0.05160 0.42120 0.33430 0.0410 Uiso calc R 1.000
H H229 0.01540 0.38450 0.32630 0.0310 Uiso calc R 1.000
H H231 0.04240 0.31430 0.29050 0.0290 Uiso calc R 1.000
H H232 0.05960 0.34630 0.23120 0.0360 Uiso calc R 1.000
H H233 0.12250 0.39370 0.23590 0.0380 Uiso calc R 1.000
H H234 0.16770 0.41000 0.30030 0.0310 Uiso calc R 1.000
H H235 0.14990 0.37960 0.36000 0.0250 Uiso calc R 1.000
H H30A 0.20400 -0.05220 0.04260 0.0450 Uiso calc R 1.000
H H30B 0.15180 -0.06470 0.04200 0.0450 Uiso calc R 1.000
H H30C 0.17930 -0.09060 0.01250 0.0450 Uiso calc R 1.000
H H30D 0.25480 -0.15140 0.09020 0.0490 Uiso calc R 1.000
H H30E 0.26560 -0.10460 0.07080 0.0490 Uiso calc R 1.000
H H30F 0.24100 -0.14370 0.04160 0.0490 Uiso calc R 1.000
H H30G 0.17350 -0.17400 0.08760 0.0410 Uiso calc R 1.000
H H30H 0.15960 -0.16270 0.03960 0.0410 Uiso calc R 1.000
H H30I 0.13300 -0.13960 0.07130 0.0410 Uiso calc R 1.000
H H30J 0.19500 -0.06860 0.20860 0.0400 Uiso calc R 1.000
H H30K 0.24670 -0.08420 0.21180 0.0400 Uiso calc R 1.000
H H30L 0.21290 -0.11340 0.23280 0.0400 Uiso calc R 1.000
H H30M 0.22350 -0.18000 0.14590 0.0370 Uiso calc R 1.000
H H30N 0.23530 -0.17840 0.19500 0.0370 Uiso calc R 1.000
H H30O 0.26450 -0.14940 0.16910 0.0370 Uiso calc R 1.000
H H30P 0.14220 -0.15560 0.14170 0.0360 Uiso calc R 1.000
H H30Q 0.13170 -0.11330 0.16780 0.0360 Uiso calc R 1.000
H H30R 0.15170 -0.15820 0.19080 0.0360 Uiso calc R 1.000
H H31A 0.24750 0.15280 0.11610 0.0420 Uiso calc R 1.000
H H31B 0.20160 0.14830 0.08200 0.0420 Uiso calc R 1.000
H H31C 0.25020 0.14600 0.06890 0.0420 Uiso calc R 1.000
H H31D 0.29880 0.08740 0.13430 0.0550 Uiso calc R 1.000
H H31E 0.30050 0.07930 0.08710 0.0550 Uiso calc R 1.000
H H31F 0.28550 0.03960 0.11380 0.0550 Uiso calc R 1.000
H H31G 0.18160 0.07600 0.04570 0.0460 Uiso calc R 1.000
H H31H 0.21340 0.03300 0.05730 0.0460 Uiso calc R 1.000
H H31I 0.23100 0.07440 0.03420 0.0460 Uiso calc R 1.000
H H31J 0.29160 0.05630 0.19230 0.0450 Uiso calc R 1.000
H H31K 0.25620 0.02340 0.20760 0.0450 Uiso calc R 1.000
H H31L 0.27970 0.06300 0.23680 0.0450 Uiso calc R 1.000
H H31M 0.17810 0.05170 0.21290 0.0460 Uiso calc R 1.000
H H31N 0.16670 0.10370 0.20570 0.0460 Uiso calc R 1.000
H H31O 0.20450 0.08790 0.24430 0.0460 Uiso calc R 1.000
H H31P 0.27130 0.13640 0.17840 0.0570 Uiso calc R 1.000
H H31Q 0.25640 0.14180 0.22180 0.0570 Uiso calc R 1.000
H H31R 0.22130 0.15430 0.18030 0.0570 Uiso calc R 1.000
H H31S 0.13730 0.10440 0.09410 0.0340 Uiso calc R 1.000
H H31T 0.16100 0.13620 0.13090 0.0340 Uiso calc R 1.000
H H31U 0.12770 0.09700 0.13930 0.0340 Uiso calc R 1.000
H H319 0.00560 0.01850 0.09030 0.0280 Uiso calc R 1.000
H H320 -0.03190 0.05120 0.02870 0.0370 Uiso calc R 1.000
H H321 0.00900 0.07100 -0.02130 0.0400 Uiso calc R 1.000
H H322 0.08730 0.05690 -0.01080 0.0370 Uiso calc R 1.000
H H323 0.12550 0.02610 0.05110 0.0290 Uiso calc R 1.000
H H325 0.08270 -0.07680 0.06830 0.0280 Uiso calc R 1.000
H H326 0.04410 -0.14540 0.06310 0.0360 Uiso calc R 1.000
H H327 0.00750 -0.16820 0.11590 0.0400 Uiso calc R 1.000
H H328 0.00510 -0.12090 0.17030 0.0400 Uiso calc R 1.000
H H329 0.04310 -0.05210 0.17600 0.0310 Uiso calc R 1.000
H H331 0.12230 -0.01820 0.21120 0.0300 Uiso calc R 1.000
H H332 0.10130 0.01280 0.26940 0.0370 Uiso calc R 1.000
H H333 0.05270 0.07480 0.26290 0.0390 Uiso calc R 1.000
H H334 0.02270 0.10440 0.19760 0.0340 Uiso calc R 1.000
H H335 0.04240 0.07280 0.13860 0.0260 Uiso calc R 1.000
H H40A 0.25350 0.45060 0.03850 0.0460 Uiso calc R 1.000
H H40B 0.21400 0.47750 0.00840 0.0460 Uiso calc R 1.000
H H40C 0.20100 0.44040 0.03880 0.0460 Uiso calc R 1.000
H H40D 0.15490 0.49370 0.07070 0.0430 Uiso calc R 1.000
H H40E 0.16390 0.52950 0.03750 0.0430 Uiso calc R 1.000
H H40F 0.17500 0.54190 0.08530 0.0430 Uiso calc R 1.000
H H40G 0.28700 0.52700 0.06630 0.0420 Uiso calc R 1.000
H H40H 0.25350 0.56250 0.08080 0.0420 Uiso calc R 1.000
H H40I 0.24640 0.54870 0.03340 0.0420 Uiso calc R 1.000
H H40J 0.23730 0.47460 0.20790 0.0400 Uiso calc R 1.000
H H40K 0.28110 0.50350 0.22810 0.0400 Uiso calc R 1.000
H H40L 0.28720 0.45830 0.20410 0.0400 Uiso calc R 1.000
H H40M 0.31020 0.54260 0.13520 0.0370 Uiso calc R 1.000
H H40N 0.33270 0.50320 0.16500 0.0370 Uiso calc R 1.000
H H40O 0.32140 0.55000 0.18390 0.0370 Uiso calc R 1.000
H H40P 0.20030 0.53950 0.16550 0.0380 Uiso calc R 1.000
H H40Q 0.22920 0.56830 0.13930 0.0380 Uiso calc R 1.000
H H40R 0.24190 0.56960 0.18850 0.0380 Uiso calc R 1.000
H H41A 0.22730 0.24210 0.07450 0.0480 Uiso calc R 1.000
H H41B 0.17280 0.24330 0.06160 0.0480 Uiso calc R 1.000
H H41C 0.19700 0.23510 0.10850 0.0480 Uiso calc R 1.000
H H41D 0.15490 0.34750 0.10800 0.0480 Uiso calc R 1.000
H H41E 0.15160 0.29910 0.12780 0.0480 Uiso calc R 1.000
H H41F 0.12930 0.30770 0.08050 0.0480 Uiso calc R 1.000
H H41G 0.22950 0.31470 0.04060 0.0460 Uiso calc R 1.000
H H41H 0.20320 0.35720 0.05360 0.0460 Uiso calc R 1.000
H H41I 0.17500 0.31680 0.02920 0.0460 Uiso calc R 1.000
H H41J 0.18240 0.33100 0.18670 0.0420 Uiso calc R 1.000
H H41K 0.22370 0.36490 0.20200 0.0420 Uiso calc R 1.000
H H41L 0.21390 0.32530 0.23140 0.0420 Uiso calc R 1.000
H H41M 0.31410 0.28490 0.20320 0.0460 Uiso calc R 1.000
H H41N 0.29230 0.30220 0.24060 0.0460 Uiso calc R 1.000
H H41O 0.30580 0.33720 0.20860 0.0460 Uiso calc R 1.000
H H41P 0.24970 0.23450 0.17520 0.0530 Uiso calc R 1.000
H H41Q 0.19840 0.25140 0.17190 0.0530 Uiso calc R 1.000
H H41R 0.23140 0.24620 0.21600 0.0530 Uiso calc R 1.000
H H41S 0.29610 0.28370 0.09100 0.0330 Uiso calc R 1.000
H H41T 0.28910 0.25270 0.12850 0.0330 Uiso calc R 1.000
H H41U 0.32550 0.29250 0.13610 0.0330 Uiso calc R 1.000
H H419 0.42810 0.37690 0.09100 0.0250 Uiso calc R 1.000
H H420 0.44340 0.34360 0.03170 0.0290 Uiso calc R 1.000
H H421 0.38380 0.31570 -0.01870 0.0310 Uiso calc R 1.000
H H422 0.30860 0.32180 -0.00990 0.0310 Uiso calc R 1.000
H H423 0.29270 0.35520 0.04940 0.0250 Uiso calc R 1.000
H H425 0.33850 0.46380 0.06230 0.0320 Uiso calc R 1.000
H H426 0.37410 0.53210 0.05470 0.0410 Uiso calc R 1.000
H H427 0.43150 0.55920 0.10770 0.0430 Uiso calc R 1.000
H H428 0.45700 0.51560 0.16570 0.0420 Uiso calc R 1.000
H H429 0.42300 0.44620 0.17320 0.0320 Uiso calc R 1.000
H H431 0.36030 0.41030 0.20830 0.0290 Uiso calc R 1.000
H H432 0.40640 0.38090 0.26770 0.0380 Uiso calc R 1.000
H H433 0.45270 0.31870 0.26270 0.0380 Uiso calc R 1.000
H H434 0.45470 0.28800 0.19870 0.0330 Uiso calc R 1.000
H H435 0.41040 0.31890 0.13870 0.0240 Uiso calc R 1.000
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pt1 P14 C118 . . . 114.36(12) yes
Pt2 P24 C218 . . . 116.73(11) yes
Pt3 P34 C318 . . . 114.86(12) yes
Pt4 P44 C418 . . . 116.67(12) yes
P11 Pt1 P13 . . . 147.08(3) yes
P21 Pt2 P23 . . . 146.73(3) yes
P31 Pt3 P33 . . . 147.17(3) yes
P41 Pt4 P43 . . . 146.67(3) yes
P11 Pt1 P14 . . . 110.86(3) no
P21 Pt2 P24 . . . 110.80(3) no
P31 Pt3 P34 . . . 110.92(3) no
P41 Pt4 P44 . . . 110.79(3) no
P13 Pt1 P14 . . . 102.00(3) yes
P23 Pt2 P24 . . . 102.42(3) yes
P33 Pt3 P34 . . . 101.84(3) yes
P43 Pt4 P44 . . . 102.50(3) yes
P11 Pt1 P12 . . . 51.68(3) no
P12 Pt1 P13 . . . 95.51(3) no
P12 Pt1 P14 . . . 162.46(3) no
P21 Pt2 P22 . . . 51.69(3) no
P22 Pt2 P23 . . . 95.25(3) no
P22 Pt2 P24 . . . 162.14(3) no
P32 Pt3 P33 . . . 95.63(3) no
P31 Pt3 P32 . . . 51.68(3) no
P32 Pt3 P34 . . . 162.51(3) no
P42 Pt4 P43 . . . 95.17(3) no
P42 Pt4 P44 . . . 162.17(3) no
P41 Pt4 P42 . . . 51.69(3) no
P12 P11 C101 . . . 113.10(12) no
Pt1 P11 P12 . . . 66.33(4) no
Pt1 P11 C105 . . . 118.38(12) no
C101 P11 C105 . . . 112.06(16) no
Pt1 P11 C101 . . . 122.00(12) no
P12 P11 C105 . . . 117.30(12) no
Pt1 P12 P11 . . . 61.99(4) no
Pt1 P13 C117 . . . 114.44(12) no
Pt1 P13 C109 . . . 114.73(13) no
Pt1 P13 C113 . . . 113.67(13) no
C113 P13 C117 . . . 101.70(17) no
C109 P13 C117 . . . 100.32(17) no
C109 P13 C113 . . . 110.49(17) no
Pt1 P14 C130 . . . 114.81(11) no
Pt1 P14 C124 . . . 120.25(12) no
C118 P14 C130 . . . 106.56(16) no
C118 P14 C124 . . . 98.69(16) no
C124 P14 C130 . . . 99.86(16) no
C201 P21 C205 . . . 112.00(16) no
Pt2 P21 C201 . . . 121.40(12) no
Pt2 P21 C205 . . . 119.05(12) no
Pt2 P21 P22 . . . 66.13(4) no
P22 P21 C201 . . . 113.02(12) no
P22 P21 C205 . . . 117.54(12) no
Pt2 P22 P21 . . . 62.19(4) no
Pt2 P23 C217 . . . 114.91(13) no
C213 P23 C217 . . . 100.87(17) no
Pt2 P23 C209 . . . 114.14(12) no
Pt2 P23 C213 . . . 114.40(12) no
C209 P23 C213 . . . 110.37(17) no
C209 P23 C217 . . . 100.62(17) no
Pt2 P24 C224 . . . 120.14(11) no
C218 P24 C224 . . . 96.73(17) no
C218 P24 C230 . . . 105.26(16) no
Pt2 P24 C230 . . . 113.75(11) no
C224 P24 C230 . . . 101.66(16) no
Pt3 P31 C301 . . . 121.73(12) no
C301 P31 C305 . . . 112.51(16) no
Pt3 P31 P32 . . . 66.15(4) no
P32 P31 C301 . . . 112.99(13) no
Pt3 P31 C305 . . . 118.27(12) no
P32 P31 C305 . . . 117.22(12) no
Pt3 P32 P31 . . . 62.17(4) no
Pt3 P33 C313 . . . 113.93(12) no
C309 P33 C317 . . . 100.44(17) no
Pt3 P33 C309 . . . 114.50(12) no
C309 P33 C313 . . . 110.46(17) no
C313 P33 C317 . . . 101.64(17) no
Pt3 P33 C317 . . . 114.39(12) no
Pt3 P34 C324 . . . 120.19(12) no
C324 P34 C330 . . . 100.23(16) no
C318 P34 C330 . . . 106.27(16) no
Pt3 P34 C330 . . . 114.83(12) no
C318 P34 C324 . . . 98.05(16) no
C401 P41 C405 . . . 112.08(16) no
P42 P41 C401 . . . 113.07(13) no
P42 P41 C405 . . . 117.53(12) no
Pt4 P41 C401 . . . 121.42(12) no
Pt4 P41 P42 . . . 66.11(4) no
Pt4 P41 C405 . . . 118.89(12) no
Pt4 P42 P41 . . . 62.20(4) no
Pt4 P43 C417 . . . 114.50(12) no
C409 P43 C413 . . . 110.47(17) no
C413 P43 C417 . . . 101.30(17) no
C409 P43 C417 . . . 100.55(17) no
Pt4 P43 C409 . . . 114.11(12) no
Pt4 P43 C413 . . . 114.40(12) no
C424 P44 C430 . . . 100.85(17) no
C418 P44 C430 . . . 105.18(16) no
Pt4 P44 C430 . . . 114.12(12) no
Pt4 P44 C424 . . . 120.34(12) no
C418 P44 C424 . . . 96.98(16) no
C102 C101 C104 . . . 109.3(3) no
P11 C101 C102 . . . 106.8(2) no
P11 C101 C103 . . . 108.3(3) no
C102 C101 C103 . . . 108.2(3) no
C103 C101 C104 . . . 109.4(3) no
P11 C101 C104 . . . 114.7(3) no
C107 C105 C108 . . . 110.3(3) no
C106 C105 C108 . . . 107.8(3) no
P11 C105 C106 . . . 106.3(2) no
P11 C105 C108 . . . 111.7(2) no
C106 C105 C107 . . . 109.1(3) no
P11 C105 C107 . . . 111.5(2) no
P13 C109 C110 . . . 113.9(3) no
C111 C109 C112 . . . 108.2(3) no
C110 C109 C112 . . . 107.3(3) no
P13 C109 C111 . . . 111.5(3) no
P13 C109 C112 . . . 107.4(3) no
C110 C109 C111 . . . 108.3(3) no
P13 C113 C115 . . . 105.7(3) no
P13 C113 C116 . . . 114.5(3) no
C114 C113 C115 . . . 108.6(3) no
P13 C113 C114 . . . 111.2(3) no
C114 C113 C116 . . . 109.0(3) no
C115 C113 C116 . . . 107.7(3) no
P14 C118 C123 . . . 118.3(3) no
C119 C118 C123 . . . 118.9(3) no
P14 C118 C119 . . . 122.7(3) no
C118 C119 C120 . . . 120.1(4) no
C119 C120 C121 . . . 120.2(4) no
C120 C121 C122 . . . 120.1(4) no
C121 C122 C123 . . . 119.9(4) no
C118 C123 C122 . . . 120.8(4) no
P14 C124 C129 . . . 125.1(3) no
C125 C124 C129 . . . 118.6(3) no
P14 C124 C125 . . . 116.3(3) no
C124 C125 C126 . . . 120.7(4) no
C125 C126 C127 . . . 119.9(4) no
C126 C127 C128 . . . 119.1(4) no
C127 C128 C129 . . . 121.0(4) no
C124 C129 C128 . . . 120.7(4) no
C131 C130 C135 . . . 118.3(3) no
P14 C130 C135 . . . 125.4(3) no
P14 C130 C131 . . . 116.4(3) no
C130 C131 C132 . . . 120.7(4) no
C131 C132 C133 . . . 120.4(4) no
C132 C133 C134 . . . 119.7(4) no
C133 C134 C135 . . . 120.5(4) no
C130 C135 C134 . . . 120.4(3) no
C101 C102 H10B . . . 110.00 no
H10A C102 H10B . . . 109.00 no
C101 C102 H10C . . . 109.00 no
H10A C102 H10C . . . 110.00 no
H10B C102 H10C . . . 109.00 no
C101 C102 H10A . . . 110.00 no
H10D C103 H10E . . . 110.00 no
C101 C103 H10D . . . 109.00 no
C101 C103 H10F . . . 110.00 no
C101 C103 H10E . . . 109.00 no
H10E C103 H10F . . . 110.00 no
H10D C103 H10F . . . 109.00 no
C101 C104 H10G . . . 110.00 no
H10G C104 H10I . . . 109.00 no
H10H C104 H10I . . . 109.00 no
C101 C104 H10I . . . 110.00 no
H10G C104 H10H . . . 110.00 no
C101 C104 H10H . . . 110.00 no
H10K C106 H10L . . . 109.00 no
H10J C106 H10K . . . 109.00 no
H10J C106 H10L . . . 109.00 no
C105 C106 H10J . . . 109.00 no
C105 C106 H10K . . . 109.00 no
C105 C106 H10L . . . 110.00 no
C105 C107 H10M . . . 110.00 no
H10N C107 H10O . . . 109.00 no
C105 C107 H10N . . . 109.00 no
H10M C107 H10O . . . 109.00 no
C105 C107 H10O . . . 110.00 no
H10M C107 H10N . . . 109.00 no
H10P C108 H10R . . . 110.00 no
C105 C108 H10Q . . . 109.00 no
H10Q C108 H10R . . . 109.00 no
H10P C108 H10Q . . . 109.00 no
C105 C108 H10R . . . 109.00 no
C105 C108 H10P . . . 109.00 no
H11B C110 H11C . . . 109.00 no
C109 C110 H11A . . . 109.00 no
C109 C110 H11B . . . 110.00 no
H11A C110 H11B . . . 110.00 no
H11A C110 H11C . . . 109.00 no
C109 C110 H11C . . . 109.00 no
C109 C111 H11D . . . 110.00 no
H11E C111 H11F . . . 109.00 no
C109 C111 H11E . . . 109.00 no
C109 C111 H11F . . . 109.00 no
H11D C111 H11F . . . 109.00 no
H11D C111 H11E . . . 110.00 no
H11G C112 H11H . . . 110.00 no
C109 C112 H11H . . . 109.00 no
H11G C112 H11I . . . 109.00 no
H11H C112 H11I . . . 109.00 no
C109 C112 H11I . . . 110.00 no
C109 C112 H11G . . . 110.00 no
H11K C114 H11L . . . 109.00 no
H11J C114 H11L . . . 110.00 no
H11J C114 H11K . . . 109.00 no
C113 C114 H11L . . . 109.00 no
C113 C114 H11J . . . 109.00 no
C113 C114 H11K . . . 109.00 no
H11M C115 H11N . . . 109.00 no
C113 C115 H11M . . . 109.00 no
H11N C115 H11O . . . 109.00 no
C113 C115 H11O . . . 110.00 no
C113 C115 H11N . . . 110.00 no
H11M C115 H11O . . . 110.00 no
H11P C116 H11Q . . . 109.00 no
C113 C116 H11P . . . 110.00 no
H11Q C116 H11R . . . 109.00 no
C113 C116 H11R . . . 109.00 no
C113 C116 H11Q . . . 109.00 no
H11P C116 H11R . . . 110.00 no
P13 C117 H11S . . . 109.00 no
P13 C117 H11U . . . 109.00 no
H11S C117 H11T . . . 109.00 no
P13 C117 H11T . . . 110.00 no
H11T C117 H11U . . . 110.00 no
H11S C117 H11U . . . 109.00 no
C118 C119 H119 . . . 120.00 no
C120 C119 H119 . . . 120.00 no
C119 C120 H120 . . . 120.00 no
C121 C120 H120 . . . 120.00 no
C120 C121 H121 . . . 120.00 no
C122 C121 H121 . . . 120.00 no
C123 C122 H122 . . . 120.00 no
C121 C122 H122 . . . 120.00 no
C118 C123 H123 . . . 120.00 no
C122 C123 H123 . . . 120.00 no
C126 C125 H125 . . . 120.00 no
C124 C125 H125 . . . 120.00 no
C127 C126 H126 . . . 120.00 no
C125 C126 H126 . . . 120.00 no
C128 C127 H127 . . . 121.00 no
C126 C127 H127 . . . 120.00 no
C127 C128 H128 . . . 120.00 no
C129 C128 H128 . . . 119.00 no
C124 C129 H129 . . . 120.00 no
C128 C129 H129 . . . 120.00 no
C130 C131 H131 . . . 120.00 no
C132 C131 H131 . . . 120.00 no
C131 C132 H132 . . . 120.00 no
C133 C132 H132 . . . 120.00 no
C132 C133 H133 . . . 120.00 no
C134 C133 H133 . . . 120.00 no
C135 C134 H134 . . . 120.00 no
C133 C134 H134 . . . 120.00 no
C134 C135 H135 . . . 120.00 no
C130 C135 H135 . . . 120.00 no
P21 C201 C204 . . . 115.0(3) no
P21 C201 C203 . . . 108.4(2) no
C202 C201 C204 . . . 109.2(3) no
P21 C201 C202 . . . 106.7(3) no
C203 C201 C204 . . . 109.2(3) no
C202 C201 C203 . . . 108.2(3) no
C206 C205 C207 . . . 109.3(3) no
P21 C205 C207 . . . 111.1(2) no
P21 C205 C208 . . . 111.5(2) no
C207 C205 C208 . . . 110.7(3) no
C206 C205 C208 . . . 107.9(3) no
P21 C205 C206 . . . 106.2(2) no
P23 C209 C212 . . . 107.7(3) no
C211 C209 C212 . . . 108.1(3) no
P23 C209 C211 . . . 111.3(3) no
C210 C209 C212 . . . 106.9(3) no
P23 C209 C210 . . . 113.9(3) no
C210 C209 C211 . . . 108.8(3) no
P23 C213 C214 . . . 112.0(3) no
C214 C213 C216 . . . 108.4(3) no
C215 C213 C216 . . . 108.0(3) no
C214 C213 C215 . . . 107.9(3) no
P23 C213 C215 . . . 105.9(3) no
P23 C213 C216 . . . 114.5(3) no
P24 C218 C219 . . . 122.2(3) no
P24 C218 C223 . . . 119.4(3) no
C219 C218 C223 . . . 118.3(3) no
C218 C219 C220 . . . 120.1(3) no
C219 C220 C221 . . . 120.6(4) no
C220 C221 C222 . . . 119.6(3) no
C221 C222 C223 . . . 119.9(3) no
C218 C223 C222 . . . 121.3(3) no
C225 C224 C229 . . . 118.4(3) no
P24 C224 C225 . . . 117.7(3) no
P24 C224 C229 . . . 123.9(3) no
C224 C225 C226 . . . 121.4(4) no
C225 C226 C227 . . . 119.9(4) no
C226 C227 C228 . . . 119.8(4) no
C227 C228 C229 . . . 120.4(4) no
C224 C229 C228 . . . 120.1(4) no
C231 C230 C235 . . . 118.4(3) no
P24 C230 C235 . . . 125.1(3) no
P24 C230 C231 . . . 116.5(3) no
C230 C231 C232 . . . 120.6(4) no
C231 C232 C233 . . . 120.3(4) no
C232 C233 C234 . . . 119.6(4) no
C233 C234 C235 . . . 120.4(4) no
C230 C235 C234 . . . 120.7(4) no
H20B C202 H20C . . . 109.00 no
C201 C202 H20A . . . 109.00 no
C201 C202 H20C . . . 109.00 no
H20A C202 H20C . . . 110.00 no
H20A C202 H20B . . . 109.00 no
C201 C202 H20B . . . 109.00 no
H20D C203 H20F . . . 110.00 no
C201 C203 H20F . . . 110.00 no
H20D C203 H20E . . . 109.00 no
C201 C203 H20D . . . 109.00 no
H20E C203 H20F . . . 109.00 no
C201 C203 H20E . . . 110.00 no
C201 C204 H20I . . . 110.00 no
H20G C204 H20I . . . 109.00 no
H20H C204 H20I . . . 109.00 no
C201 C204 H20G . . . 110.00 no
C201 C204 H20H . . . 109.00 no
H20G C204 H20H . . . 109.00 no
C205 C206 H20K . . . 110.00 no
C205 C206 H20L . . . 109.00 no
H20K C206 H20L . . . 109.00 no
H20J C206 H20L . . . 110.00 no
C205 C206 H20J . . . 110.00 no
H20J C206 H20K . . . 109.00 no
C205 C207 H20N . . . 110.00 no
C205 C207 H20M . . . 110.00 no
H20M C207 H20O . . . 109.00 no
H20N C207 H20O . . . 109.00 no
H20M C207 H20N . . . 109.00 no
C205 C207 H20O . . . 109.00 no
H20P C208 H20Q . . . 110.00 no
C205 C208 H20R . . . 109.00 no
C205 C208 H20P . . . 109.00 no
H20P C208 H20R . . . 109.00 no
C205 C208 H20Q . . . 110.00 no
H20Q C208 H20R . . . 110.00 no
H21B C210 H21C . . . 109.00 no
C209 C210 H21C . . . 109.00 no
H21A C210 H21B . . . 110.00 no
C209 C210 H21B . . . 109.00 no
C209 C210 H21A . . . 109.00 no
H21A C210 H21C . . . 110.00 no
H21E C211 H21F . . . 110.00 no
C209 C211 H21D . . . 110.00 no
C209 C211 H21E . . . 109.00 no
C209 C211 H21F . . . 109.00 no
H21D C211 H21E . . . 110.00 no
H21D C211 H21F . . . 109.00 no
C209 C212 H21I . . . 109.00 no
H21G C212 H21H . . . 109.00 no
C209 C212 H21G . . . 109.00 no
H21H C212 H21I . . . 110.00 no
C209 C212 H21H . . . 109.00 no
H21G C212 H21I . . . 109.00 no
H21K C214 H21L . . . 109.00 no
H21J C214 H21L . . . 109.00 no
C213 C214 H21K . . . 110.00 no
H21J C214 H21K . . . 109.00 no
C213 C214 H21J . . . 109.00 no
C213 C214 H21L . . . 109.00 no
C213 C215 H21O . . . 109.00 no
H21M C215 H21N . . . 110.00 no
H21N C215 H21O . . . 109.00 no
H21M C215 H21O . . . 109.00 no
C213 C215 H21N . . . 109.00 no
C213 C215 H21M . . . 109.00 no
C213 C216 H21P . . . 109.00 no
H21P C216 H21R . . . 109.00 no
H21P C216 H21Q . . . 109.00 no
C213 C216 H21R . . . 109.00 no
C213 C216 H21Q . . . 109.00 no
H21Q C216 H21R . . . 110.00 no
P23 C217 H21T . . . 109.00 no
P23 C217 H21U . . . 109.00 no
H21S C217 H21T . . . 110.00 no
H21S C217 H21U . . . 109.00 no
H21T C217 H21U . . . 109.00 no
P23 C217 H21S . . . 110.00 no
C220 C219 H219 . . . 120.00 no
C218 C219 H219 . . . 120.00 no
C219 C220 H220 . . . 120.00 no
C221 C220 H220 . . . 120.00 no
C220 C221 H221 . . . 120.00 no
C222 C221 H221 . . . 120.00 no
C223 C222 H222 . . . 120.00 no
C221 C222 H222 . . . 120.00 no
C222 C223 H223 . . . 119.00 no
C218 C223 H223 . . . 119.00 no
C224 C225 H225 . . . 119.00 no
C226 C225 H225 . . . 119.00 no
C225 C226 H226 . . . 120.00 no
C227 C226 H226 . . . 120.00 no
C228 C227 H227 . . . 120.00 no
C226 C227 H227 . . . 120.00 no
C229 C228 H228 . . . 120.00 no
C227 C228 H228 . . . 120.00 no
C228 C229 H229 . . . 120.00 no
C224 C229 H229 . . . 120.00 no
C230 C231 H231 . . . 120.00 no
C232 C231 H231 . . . 120.00 no
C233 C232 H232 . . . 120.00 no
C231 C232 H232 . . . 120.00 no
C234 C233 H233 . . . 120.00 no
C232 C233 H233 . . . 120.00 no
C233 C234 H234 . . . 120.00 no
C235 C234 H234 . . . 120.00 no
C234 C235 H235 . . . 120.00 no
C230 C235 H235 . . . 120.00 no
P31 C301 C302 . . . 107.4(2) no
P31 C301 C303 . . . 108.8(3) no
C302 C301 C303 . . . 108.0(3) no
C302 C301 C304 . . . 108.9(3) no
P31 C301 C304 . . . 114.5(3) no
C303 C301 C304 . . . 109.0(3) no
P31 C305 C308 . . . 111.8(3) no
C306 C305 C307 . . . 108.9(3) no
P31 C305 C307 . . . 111.0(3) no
C307 C305 C308 . . . 110.4(3) no
C306 C305 C308 . . . 108.1(3) no
P31 C305 C306 . . . 106.5(2) no
P33 C309 C310 . . . 113.5(3) no
P33 C309 C312 . . . 107.6(3) no
C310 C309 C311 . . . 108.4(3) no
C310 C309 C312 . . . 107.3(3) no
C311 C309 C312 . . . 108.8(3) no
P33 C309 C311 . . . 111.1(3) no
P33 C313 C314 . . . 111.3(3) no
P33 C313 C315 . . . 105.9(3) no
C315 C313 C316 . . . 108.1(3) no
C314 C313 C316 . . . 108.4(3) no
P33 C313 C316 . . . 114.7(3) no
C314 C313 C315 . . . 108.1(3) no
P34 C318 C323 . . . 118.0(3) no
P34 C318 C319 . . . 123.2(3) no
C319 C318 C323 . . . 118.6(3) no
C318 C319 C320 . . . 120.3(4) no
C319 C320 C321 . . . 120.2(4) no
C320 C321 C322 . . . 120.1(4) no
C321 C322 C323 . . . 120.0(4) no
C318 C323 C322 . . . 120.6(4) no
C325 C324 C329 . . . 118.5(3) no
P34 C324 C325 . . . 117.0(3) no
P34 C324 C329 . . . 124.6(3) no
C324 C325 C326 . . . 120.8(4) no
C325 C326 C327 . . . 119.7(4) no
C326 C327 C328 . . . 120.0(4) no
C327 C328 C329 . . . 120.9(4) no
C324 C329 C328 . . . 120.2(4) no
P34 C330 C331 . . . 115.8(3) no
P34 C330 C335 . . . 125.5(3) no
C331 C330 C335 . . . 118.7(3) no
C330 C331 C332 . . . 120.7(4) no
C331 C332 C333 . . . 120.2(4) no
C332 C333 C334 . . . 119.8(4) no
C333 C334 C335 . . . 120.4(4) no
C330 C335 C334 . . . 120.2(3) no
H30B C302 H30C . . . 109.00 no
C301 C302 H30A . . . 109.00 no
C301 C302 H30B . . . 110.00 no
C301 C302 H30C . . . 110.00 no
H30A C302 H30C . . . 109.00 no
H30A C302 H30B . . . 109.00 no
H30D C303 H30E . . . 109.00 no
H30D C303 H30F . . . 109.00 no
C301 C303 H30F . . . 110.00 no
C301 C303 H30E . . . 109.00 no
C301 C303 H30D . . . 110.00 no
H30E C303 H30F . . . 109.00 no
C301 C304 H30G . . . 109.00 no
C301 C304 H30H . . . 110.00 no
H30G C304 H30H . . . 110.00 no
H30G C304 H30I . . . 109.00 no
H30H C304 H30I . . . 109.00 no
C301 C304 H30I . . . 109.00 no
C305 C306 H30K . . . 110.00 no
C305 C306 H30L . . . 109.00 no
C305 C306 H30J . . . 110.00 no
H30K C306 H30L . . . 109.00 no
H30J C306 H30L . . . 109.00 no
H30J C306 H30K . . . 109.00 no
C305 C307 H30N . . . 110.00 no
C305 C307 H30M . . . 110.00 no
H30M C307 H30O . . . 109.00 no
C305 C307 H30O . . . 109.00 no
H30M C307 H30N . . . 109.00 no
H30N C307 H30O . . . 110.00 no
C305 C308 H30Q . . . 109.00 no
C305 C308 H30R . . . 109.00 no
C305 C308 H30P . . . 110.00 no
H30P C308 H30R . . . 110.00 no
H30Q C308 H30R . . . 109.00 no
H30P C308 H30Q . . . 109.00 no
H31A C310 H31B . . . 109.00 no
H31A C310 H31C . . . 109.00 no
H31B C310 H31C . . . 110.00 no
C309 C310 H31A . . . 109.00 no
C309 C310 H31B . . . 109.00 no
C309 C310 H31C . . . 110.00 no
C309 C311 H31D . . . 109.00 no
C309 C311 H31E . . . 109.00 no
C309 C311 H31F . . . 109.00 no
H31D C311 H31E . . . 109.00 no
H31D C311 H31F . . . 110.00 no
H31E C311 H31F . . . 110.00 no
C309 C312 H31G . . . 109.00 no
C309 C312 H31H . . . 110.00 no
C309 C312 H31I . . . 109.00 no
H31G C312 H31H . . . 109.00 no
H31H C312 H31I . . . 110.00 no
H31G C312 H31I . . . 109.00 no
C313 C314 H31K . . . 109.00 no
C313 C314 H31L . . . 109.00 no
C313 C314 H31J . . . 109.00 no
H31J C314 H31L . . . 109.00 no
H31K C314 H31L . . . 110.00 no
H31J C314 H31K . . . 110.00 no
C313 C315 H31M . . . 109.00 no
C313 C315 H31N . . . 110.00 no
C313 C315 H31O . . . 109.00 no
H31M C315 H31N . . . 109.00 no
H31M C315 H31O . . . 109.00 no
H31N C315 H31O . . . 110.00 no
C313 C316 H31P . . . 110.00 no
H31P C316 H31R . . . 110.00 no
H31Q C316 H31R . . . 109.00 no
H31P C316 H31Q . . . 109.00 no
C313 C316 H31Q . . . 110.00 no
C313 C316 H31R . . . 110.00 no
P33 C317 H31T . . . 110.00 no
H31S C317 H31U . . . 110.00 no
P33 C317 H31U . . . 109.00 no
H31S C317 H31T . . . 109.00 no
P33 C317 H31S . . . 109.00 no
H31T C317 H31U . . . 110.00 no
C320 C319 H319 . . . 120.00 no
C318 C319 H319 . . . 120.00 no
C319 C320 H320 . . . 120.00 no
C321 C320 H320 . . . 120.00 no
C320 C321 H321 . . . 120.00 no
C322 C321 H321 . . . 120.00 no
C323 C322 H322 . . . 120.00 no
C321 C322 H322 . . . 120.00 no
C322 C323 H323 . . . 120.00 no
C318 C323 H323 . . . 120.00 no
C324 C325 H325 . . . 120.00 no
C326 C325 H325 . . . 120.00 no
C327 C326 H326 . . . 120.00 no
C325 C326 H326 . . . 120.00 no
C328 C327 H327 . . . 120.00 no
C326 C327 H327 . . . 120.00 no
C327 C328 H328 . . . 120.00 no
C329 C328 H328 . . . 120.00 no
C328 C329 H329 . . . 120.00 no
C324 C329 H329 . . . 120.00 no
C330 C331 H331 . . . 120.00 no
C332 C331 H331 . . . 120.00 no
C331 C332 H332 . . . 120.00 no
C333 C332 H332 . . . 120.00 no
C332 C333 H333 . . . 120.00 no
C334 C333 H333 . . . 120.00 no
C333 C334 H334 . . . 120.00 no
C335 C334 H334 . . . 120.00 no
C330 C335 H335 . . . 120.00 no
C334 C335 H335 . . . 120.00 no
P41 C401 C402 . . . 106.8(2) no
P41 C401 C403 . . . 108.1(3) no
P41 C401 C404 . . . 115.0(3) no
C402 C401 C403 . . . 108.2(3) no
C402 C401 C404 . . . 108.9(3) no
C403 C401 C404 . . . 109.6(3) no
P41 C405 C406 . . . 106.2(2) no
P41 C405 C407 . . . 111.6(3) no
P41 C405 C408 . . . 111.5(3) no
C406 C405 C407 . . . 107.9(3) no
C406 C405 C408 . . . 109.6(3) no
C407 C405 C408 . . . 110.0(3) no
P43 C409 C410 . . . 113.7(3) no
P43 C409 C411 . . . 111.3(3) no
P43 C409 C412 . . . 107.7(3) no
C410 C409 C411 . . . 108.7(3) no
C410 C409 C412 . . . 107.0(3) no
C411 C409 C412 . . . 108.2(3) no
P43 C413 C414 . . . 111.5(3) no
P43 C413 C415 . . . 105.9(3) no
P43 C413 C416 . . . 114.4(3) no
C414 C413 C415 . . . 107.8(3) no
C414 C413 C416 . . . 108.8(3) no
C415 C413 C416 . . . 108.2(3) no
P44 C418 C419 . . . 122.3(3) no
P44 C418 C423 . . . 118.5(3) no
C419 C418 C423 . . . 119.2(3) no
C418 C419 C420 . . . 120.2(3) no
C419 C420 C421 . . . 120.3(4) no
C420 C421 C422 . . . 119.8(3) no
C421 C422 C423 . . . 120.2(4) no
C418 C423 C422 . . . 120.3(4) no
P44 C424 C425 . . . 116.6(3) no
P44 C424 C429 . . . 124.7(3) no
C425 C424 C429 . . . 118.7(3) no
C424 C425 C426 . . . 120.5(4) no
C425 C426 C427 . . . 120.2(4) no
C426 C427 C428 . . . 119.6(4) no
C427 C428 C429 . . . 120.8(4) no
C424 C429 C428 . . . 120.1(4) no
P44 C430 C431 . . . 116.7(3) no
P44 C430 C435 . . . 124.9(3) no
C431 C430 C435 . . . 118.3(3) no
C430 C431 C432 . . . 121.2(4) no
C431 C432 C433 . . . 119.5(4) no
C432 C433 C434 . . . 120.3(4) no
C433 C434 C435 . . . 120.2(4) no
C430 C435 C434 . . . 120.5(3) no
C401 C402 H40A . . . 109.00 no
C401 C402 H40B . . . 109.00 no
C401 C402 H40C . . . 110.00 no
H40A C402 H40B . . . 110.00 no
H40A C402 H40C . . . 109.00 no
H40B C402 H40C . . . 109.00 no
C401 C403 H40D . . . 109.00 no
C401 C403 H40E . . . 110.00 no
C401 C403 H40F . . . 109.00 no
H40D C403 H40E . . . 109.00 no
H40D C403 H40F . . . 110.00 no
H40E C403 H40F . . . 109.00 no
C401 C404 H40G . . . 109.00 no
C401 C404 H40H . . . 109.00 no
C401 C404 H40I . . . 110.00 no
H40G C404 H40H . . . 109.00 no
H40G C404 H40I . . . 109.00 no
H40H C404 H40I . . . 110.00 no
C405 C406 H40J . . . 109.00 no
C405 C406 H40K . . . 109.00 no
C405 C406 H40L . . . 109.00 no
H40J C406 H40K . . . 110.00 no
H40J C406 H40L . . . 110.00 no
H40K C406 H40L . . . 109.00 no
C405 C407 H40M . . . 109.00 no
C405 C407 H40N . . . 110.00 no
C405 C407 H40O . . . 110.00 no
H40M C407 H40N . . . 109.00 no
H40M C407 H40O . . . 109.00 no
H40N C407 H40O . . . 109.00 no
C405 C408 H40P . . . 109.00 no
C405 C408 H40Q . . . 109.00 no
C405 C408 H40R . . . 109.00 no
H40P C408 H40Q . . . 109.00 no
H40P C408 H40R . . . 109.00 no
H40Q C408 H40R . . . 110.00 no
C409 C410 H41A . . . 109.00 no
C409 C410 H41B . . . 109.00 no
C409 C410 H41C . . . 110.00 no
H41A C410 H41B . . . 109.00 no
H41A C410 H41C . . . 109.00 no
H41B C410 H41C . . . 109.00 no
C409 C411 H41D . . . 109.00 no
C409 C411 H41E . . . 109.00 no
C409 C411 H41F . . . 110.00 no
H41D C411 H41E . . . 110.00 no
H41D C411 H41F . . . 109.00 no
H41E C411 H41F . . . 109.00 no
C409 C412 H41G . . . 109.00 no
C409 C412 H41H . . . 110.00 no
C409 C412 H41I . . . 110.00 no
H41G C412 H41H . . . 110.00 no
H41G C412 H41I . . . 110.00 no
H41H C412 H41I . . . 109.00 no
C413 C414 H41J . . . 109.00 no
C413 C414 H41K . . . 110.00 no
C413 C414 H41L . . . 110.00 no
H41J C414 H41K . . . 109.00 no
H41J C414 H41L . . . 109.00 no
H41K C414 H41L . . . 109.00 no
C413 C415 H41M . . . 109.00 no
C413 C415 H41N . . . 109.00 no
C413 C415 H41O . . . 109.00 no
H41M C415 H41N . . . 109.00 no
H41M C415 H41O . . . 109.00 no
H41N C415 H41O . . . 110.00 no
C413 C416 H41P . . . 109.00 no
C413 C416 H41Q . . . 110.00 no
C413 C416 H41R . . . 110.00 no
H41P C416 H41Q . . . 109.00 no
H41P C416 H41R . . . 109.00 no
H41Q C416 H41R . . . 109.00 no
P43 C417 H41S . . . 109.00 no
P43 C417 H41T . . . 110.00 no
P43 C417 H41U . . . 109.00 no
H41S C417 H41T . . . 110.00 no
H41S C417 H41U . . . 109.00 no
H41T C417 H41U . . . 109.00 no
C418 C419 H419 . . . 120.00 no
C420 C419 H419 . . . 120.00 no
C419 C420 H420 . . . 120.00 no
C421 C420 H420 . . . 120.00 no
C420 C421 H421 . . . 120.00 no
C422 C421 H421 . . . 120.00 no
C421 C422 H422 . . . 120.00 no
C423 C422 H422 . . . 120.00 no
C418 C423 H423 . . . 120.00 no
C422 C423 H423 . . . 120.00 no
C424 C425 H425 . . . 120.00 no
C426 C425 H425 . . . 120.00 no
C425 C426 H426 . . . 120.00 no
C427 C426 H426 . . . 120.00 no
C426 C427 H427 . . . 120.00 no
C428 C427 H427 . . . 120.00 no
C427 C428 H428 . . . 120.00 no
C429 C428 H428 . . . 120.00 no
C424 C429 H429 . . . 120.00 no
C428 C429 H429 . . . 120.00 no
C430 C431 H431 . . . 119.00 no
C432 C431 H431 . . . 119.00 no
C431 C432 H432 . . . 120.00 no
C433 C432 H432 . . . 120.00 no
C432 C433 H433 . . . 120.00 no
C434 C433 H433 . . . 120.00 no
C433 C434 H434 . . . 120.00 no
C435 C434 H434 . . . 120.00 no
C430 C435 H435 . . . 120.00 no
C434 C435 H435 . . . 120.00 no
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Pt1 P11 . . 2.3255(10) yes
Pt1 P12 . . 2.4125(9) yes
Pt1 P13 . . 2.3316(10) yes
Pt1 P14 . . 2.3041(9) yes
Pt2 P21 . . 2.3309(9) yes
Pt2 P22 . . 2.4099(9) yes
Pt2 P23 . . 2.3324(10) yes
Pt2 P24 . . 2.3024(9) yes
Pt3 P31 . . 2.3288(9) yes
Pt3 P32 . . 2.4087(10) yes
Pt3 P33 . . 2.3333(9) yes
Pt3 P34 . . 2.3021(10) yes
Pt4 P41 . . 2.3308(9) yes
Pt4 P42 . . 2.4091(10) yes
Pt4 P43 . . 2.3330(9) yes
Pt4 P44 . . 2.3006(10) yes
P11 C105 . . 1.900(4) no
P11 P12 . . 2.0665(13) yes
P11 C101 . . 1.921(4) no
P13 C113 . . 1.913(4) no
P13 C109 . . 1.909(4) no
P13 C117 . . 1.853(4) no
P14 C124 . . 1.865(4) no
P14 C130 . . 1.851(4) no
P14 C118 . . 1.849(4) no
P21 C201 . . 1.920(4) no
P21 P22 . . 2.0678(13) yes
P21 C205 . . 1.900(4) no
P23 C217 . . 1.838(4) no
P23 C213 . . 1.909(4) no
P23 C209 . . 1.919(4) no
P24 C230 . . 1.849(4) no
P24 C218 . . 1.845(3) no
P24 C224 . . 1.858(4) no
P31 P32 . . 2.0661(13) yes
P31 C305 . . 1.905(4) no
P31 C301 . . 1.918(4) no
P33 C309 . . 1.906(4) no
P33 C313 . . 1.915(4) no
P33 C317 . . 1.838(4) no
P34 C318 . . 1.846(3) no
P34 C330 . . 1.850(4) no
P34 C324 . . 1.862(4) no
P41 C401 . . 1.920(4) no
P41 C405 . . 1.901(4) no
P41 P42 . . 2.0676(13) yes
P43 C417 . . 1.847(4) no
P43 C409 . . 1.916(4) no
P43 C413 . . 1.910(4) no
P44 C418 . . 1.855(3) no
P44 C430 . . 1.847(4) no
P44 C424 . . 1.863(4) no
C101 C102 . . 1.549(5) no
C101 C104 . . 1.528(5) no
C101 C103 . . 1.536(5) no
C105 C107 . . 1.535(5) no
C105 C108 . . 1.536(5) no
C105 C106 . . 1.543(5) no
C109 C110 . . 1.540(6) no
C109 C112 . . 1.548(6) no
C109 C111 . . 1.536(5) no
C113 C114 . . 1.541(6) no
C113 C115 . . 1.534(6) no
C113 C116 . . 1.543(6) no
C118 C123 . . 1.396(5) no
C118 C119 . . 1.403(5) no
C119 C120 . . 1.395(6) no
C120 C121 . . 1.388(6) no
C121 C122 . . 1.388(7) no
C122 C123 . . 1.391(5) no
C124 C129 . . 1.384(5) no
C124 C125 . . 1.405(5) no
C125 C126 . . 1.393(6) no
C126 C127 . . 1.401(6) no
C127 C128 . . 1.378(6) no
C128 C129 . . 1.394(6) no
C130 C131 . . 1.414(5) no
C130 C135 . . 1.402(5) no
C131 C132 . . 1.389(5) no
C132 C133 . . 1.389(6) no
C133 C134 . . 1.386(6) no
C134 C135 . . 1.400(5) no
C102 H10B . . 0.9800 no
C102 H10A . . 0.9800 no
C102 H10C . . 0.9800 no
C103 H10D . . 0.9800 no
C103 H10E . . 0.9800 no
C103 H10F . . 0.9800 no
C104 H10G . . 0.9800 no
C104 H10H . . 0.9800 no
C104 H10I . . 0.9800 no
C106 H10K . . 0.9800 no
C106 H10L . . 0.9800 no
C106 H10J . . 0.9800 no
C107 H10O . . 0.9800 no
C107 H10M . . 0.9800 no
C107 H10N . . 0.9800 no
C108 H10Q . . 0.9800 no
C108 H10R . . 0.9800 no
C108 H10P . . 0.9800 no
C110 H11A . . 0.9800 no
C110 H11C . . 0.9800 no
C110 H11B . . 0.9800 no
C111 H11D . . 0.9800 no
C111 H11F . . 0.9800 no
C111 H11E . . 0.9800 no
C112 H11I . . 0.9800 no
C112 H11H . . 0.9800 no
C112 H11G . . 0.9800 no
C114 H11J . . 0.9800 no
C114 H11K . . 0.9800 no
C114 H11L . . 0.9800 no
C115 H11O . . 0.9800 no
C115 H11M . . 0.9800 no
C115 H11N . . 0.9800 no
C116 H11Q . . 0.9800 no
C116 H11P . . 0.9800 no
C116 H11R . . 0.9800 no
C117 H11T . . 0.9800 no
C117 H11U . . 0.9800 no
C117 H11S . . 0.9800 no
C119 H119 . . 0.9500 no
C120 H120 . . 0.9500 no
C121 H121 . . 0.9500 no
C122 H122 . . 0.9500 no
C123 H123 . . 0.9500 no
C125 H125 . . 0.9500 no
C126 H126 . . 0.9500 no
C127 H127 . . 0.9500 no
C128 H128 . . 0.9500 no
C129 H129 . . 0.9500 no
C131 H131 . . 0.9500 no
C132 H132 . . 0.9500 no
C133 H133 . . 0.9500 no
C134 H134 . . 0.9500 no
C135 H135 . . 0.9500 no
C201 C202 . . 1.539(5) no
C201 C203 . . 1.549(5) no
C201 C204 . . 1.537(6) no
C205 C206 . . 1.544(5) no
C205 C208 . . 1.540(5) no
C205 C207 . . 1.536(5) no
C209 C211 . . 1.536(5) no
C209 C212 . . 1.552(6) no
C209 C210 . . 1.541(5) no
C213 C216 . . 1.545(6) no
C213 C214 . . 1.546(6) no
C213 C215 . . 1.546(5) no
C218 C219 . . 1.405(5) no
C218 C223 . . 1.396(5) no
C219 C220 . . 1.389(5) no
C220 C221 . . 1.395(5) no
C221 C222 . . 1.383(5) no
C222 C223 . . 1.388(5) no
C224 C229 . . 1.401(5) no
C224 C225 . . 1.397(6) no
C225 C226 . . 1.386(6) no
C226 C227 . . 1.393(6) no
C227 C228 . . 1.385(6) no
C228 C229 . . 1.403(6) no
C230 C235 . . 1.394(5) no
C230 C231 . . 1.410(5) no
C231 C232 . . 1.396(5) no
C232 C233 . . 1.386(6) no
C233 C234 . . 1.390(6) no
C234 C235 . . 1.397(6) no
C202 H20B . . 0.9800 no
C202 H20A . . 0.9800 no
C202 H20C . . 0.9800 no
C203 H20E . . 0.9800 no
C203 H20D . . 0.9800 no
C203 H20F . . 0.9800 no
C204 H20G . . 0.9800 no
C204 H20I . . 0.9800 no
C204 H20H . . 0.9800 no
C206 H20J . . 0.9800 no
C206 H20K . . 0.9800 no
C206 H20L . . 0.9800 no
C207 H20N . . 0.9800 no
C207 H20M . . 0.9800 no
C207 H20O . . 0.9800 no
C208 H20P . . 0.9800 no
C208 H20Q . . 0.9800 no
C208 H20R . . 0.9800 no
C210 H21C . . 0.9800 no
C210 H21A . . 0.9800 no
C210 H21B . . 0.9800 no
C211 H21D . . 0.9800 no
C211 H21F . . 0.9800 no
C211 H21E . . 0.9800 no
C212 H21H . . 0.9800 no
C212 H21G . . 0.9800 no
C212 H21I . . 0.9800 no
C214 H21K . . 0.9800 no
C214 H21J . . 0.9800 no
C214 H21L . . 0.9800 no
C215 H21O . . 0.9800 no
C215 H21M . . 0.9800 no
C215 H21N . . 0.9800 no
C216 H21Q . . 0.9800 no
C216 H21P . . 0.9800 no
C216 H21R . . 0.9800 no
C217 H21S . . 0.9800 no
C217 H21U . . 0.9800 no
C217 H21T . . 0.9800 no
C219 H219 . . 0.9500 no
C220 H220 . . 0.9500 no
C221 H221 . . 0.9500 no
C222 H222 . . 0.9500 no
C223 H223 . . 0.9500 no
C225 H225 . . 0.9500 no
C226 H226 . . 0.9500 no
C227 H227 . . 0.9500 no
C228 H228 . . 0.9500 no
C229 H229 . . 0.9500 no
C231 H231 . . 0.9500 no
C232 H232 . . 0.9500 no
C233 H233 . . 0.9500 no
C234 H234 . . 0.9500 no
C235 H235 . . 0.9500 no
C301 C304 . . 1.542(6) no
C301 C303 . . 1.530(6) no
C301 C302 . . 1.538(5) no
C305 C308 . . 1.531(5) no
C305 C307 . . 1.537(5) no
C305 C306 . . 1.543(5) no
C309 C311 . . 1.541(6) no
C309 C312 . . 1.545(6) no
C309 C310 . . 1.547(5) no
C313 C316 . . 1.537(6) no
C313 C314 . . 1.542(6) no
C313 C315 . . 1.534(6) no
C318 C319 . . 1.399(5) no
C318 C323 . . 1.405(5) no
C319 C320 . . 1.396(6) no
C320 C321 . . 1.383(6) no
C321 C322 . . 1.388(6) no
C322 C323 . . 1.389(5) no
C324 C325 . . 1.400(5) no
C324 C329 . . 1.399(5) no
C325 C326 . . 1.396(5) no
C326 C327 . . 1.397(6) no
C327 C328 . . 1.365(6) no
C328 C329 . . 1.399(6) no
C330 C331 . . 1.416(5) no
C330 C335 . . 1.400(5) no
C331 C332 . . 1.398(6) no
C332 C333 . . 1.392(6) no
C333 C334 . . 1.398(6) no
C334 C335 . . 1.409(5) no
C302 H30C . . 0.9800 no
C302 H30A . . 0.9800 no
C302 H30B . . 0.9800 no
C303 H30D . . 0.9800 no
C303 H30F . . 0.9800 no
C303 H30E . . 0.9800 no
C304 H30H . . 0.9800 no
C304 H30G . . 0.9800 no
C304 H30I . . 0.9800 no
C306 H30J . . 0.9800 no
C306 H30K . . 0.9800 no
C306 H30L . . 0.9800 no
C307 H30N . . 0.9800 no
C307 H30O . . 0.9800 no
C307 H30M . . 0.9800 no
C308 H30Q . . 0.9800 no
C308 H30R . . 0.9800 no
C308 H30P . . 0.9800 no
C310 H31C . . 0.9800 no
C310 H31A . . 0.9800 no
C310 H31B . . 0.9800 no
C311 H31E . . 0.9800 no
C311 H31D . . 0.9800 no
C311 H31F . . 0.9800 no
C312 H31G . . 0.9800 no
C312 H31H . . 0.9800 no
C312 H31I . . 0.9800 no
C314 H31K . . 0.9800 no
C314 H31L . . 0.9800 no
C314 H31J . . 0.9800 no
C315 H31M . . 0.9800 no
C315 H31N . . 0.9800 no
C315 H31O . . 0.9800 no
C316 H31R . . 0.9800 no
C316 H31Q . . 0.9800 no
C316 H31P . . 0.9800 no
C317 H31U . . 0.9800 no
C317 H31T . . 0.9800 no
C317 H31S . . 0.9800 no
C319 H319 . . 0.9500 no
C320 H320 . . 0.9500 no
C321 H321 . . 0.9500 no
C322 H322 . . 0.9500 no
C323 H323 . . 0.9500 no
C325 H325 . . 0.9500 no
C326 H326 . . 0.9500 no
C327 H327 . . 0.9500 no
C328 H328 . . 0.9500 no
C329 H329 . . 0.9500 no
C331 H331 . . 0.9500 no
C332 H332 . . 0.9500 no
C333 H333 . . 0.9500 no
C334 H334 . . 0.9500 no
C335 H335 . . 0.9500 no
C401 C402 . . 1.544(5) no
C401 C403 . . 1.538(6) no
C401 C404 . . 1.537(5) no
C405 C406 . . 1.547(5) no
C405 C407 . . 1.536(5) no
C405 C408 . . 1.540(5) no
C409 C410 . . 1.543(5) no
C409 C411 . . 1.530(6) no
C409 C412 . . 1.542(5) no
C413 C414 . . 1.546(6) no
C413 C415 . . 1.541(6) no
C413 C416 . . 1.534(5) no
C418 C419 . . 1.397(5) no
C418 C423 . . 1.396(5) no
C419 C420 . . 1.389(5) no
C420 C421 . . 1.391(5) no
C421 C422 . . 1.383(6) no
C422 C423 . . 1.397(5) no
C424 C425 . . 1.408(5) no
C424 C429 . . 1.394(5) no
C425 C426 . . 1.396(6) no
C426 C427 . . 1.392(6) no
C427 C428 . . 1.380(6) no
C428 C429 . . 1.403(6) no
C430 C431 . . 1.409(5) no
C430 C435 . . 1.394(5) no
C431 C432 . . 1.394(5) no
C432 C433 . . 1.393(6) no
C433 C434 . . 1.383(6) no
C434 C435 . . 1.406(5) no
C402 H40A . . 0.9800 no
C402 H40B . . 0.9800 no
C402 H40C . . 0.9800 no
C403 H40D . . 0.9800 no
C403 H40E . . 0.9800 no
C403 H40F . . 0.9800 no
C404 H40G . . 0.9800 no
C404 H40H . . 0.9800 no
C404 H40I . . 0.9800 no
C406 H40J . . 0.9800 no
C406 H40K . . 0.9800 no
C406 H40L . . 0.9800 no
C407 H40M . . 0.9800 no
C407 H40N . . 0.9800 no
C407 H40O . . 0.9800 no
C408 H40P . . 0.9800 no
C408 H40Q . . 0.9800 no
C408 H40R . . 0.9800 no
C410 H41A . . 0.9800 no
C410 H41B . . 0.9800 no
C410 H41C . . 0.9800 no
C411 H41D . . 0.9800 no
C411 H41E . . 0.9800 no
C411 H41F . . 0.9800 no
C412 H41G . . 0.9800 no
C412 H41H . . 0.9800 no
C412 H41I . . 0.9800 no
C414 H41J . . 0.9800 no
C414 H41K . . 0.9800 no
C414 H41L . . 0.9800 no
C415 H41M . . 0.9800 no
C415 H41N . . 0.9800 no
C415 H41O . . 0.9800 no
C416 H41P . . 0.9800 no
C416 H41Q . . 0.9800 no
C416 H41R . . 0.9800 no
C417 H41S . . 0.9800 no
C417 H41T . . 0.9800 no
C417 H41U . . 0.9800 no
C419 H419 . . 0.9500 no
C420 H420 . . 0.9500 no
C421 H421 . . 0.9500 no
C422 H422 . . 0.9500 no
C423 H423 . . 0.9500 no
C425 H425 . . 0.9500 no
C426 H426 . . 0.9500 no
C427 H427 . . 0.9500 no
C428 H428 . . 0.9500 no
C429 H429 . . 0.9500 no
C431 H431 . . 0.9500 no
C432 H432 . . 0.9500 no
C433 H433 . . 0.9500 no
C434 H434 . . 0.9500 no
C435 H435 . . 0.9500 no
loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
_geom_contact_publ_flag
Pt1 H10A 3.2900 . . no
Pt1 H10B 3.4400 . . no
Pt1 H10J 3.1100 . . no
Pt1 H11E 3.6200 . . no
Pt1 H11I 3.0500 . . no
Pt1 H11L 3.1900 . . no
Pt1 H11N 3.2800 . . no
Pt1 H123 2.9700 . . no
Pt1 H131 3.5100 . . no
Pt2 H20K 3.1500 . . no
Pt2 H21D 3.6500 . . no
Pt2 H21G 3.0200 . . no
Pt2 H21L 3.2500 . . no
Pt2 H21N 3.3000 . . no
Pt2 H20A 3.4100 . . no
Pt2 H20C 3.2800 . . no
Pt2 H231 3.4900 . . no
Pt2 H223 3.0700 . . no
Pt3 H30A 3.4000 . . no
Pt3 H331 3.4900 . . no
Pt3 H31F 3.6100 . . no
Pt3 H30B 3.3400 . . no
Pt3 H30J 3.1300 . . no
Pt3 H323 2.9800 . . no
Pt3 H31M 3.2900 . . no
Pt3 H31H 3.0600 . . no
Pt3 H31K 3.2200 . . no
Pt4 H431 3.4900 . . no
Pt4 H40C 3.4300 . . no
Pt4 H40L 3.1300 . . no
Pt4 H41D 3.6500 . . no
Pt4 H423 3.0600 . . no
Pt4 H41H 3.0200 . . no
Pt4 H41K 3.2300 . . no
Pt4 H40A 3.2700 . . no
Pt4 H41O 3.2800 . . no
P12 C111 3.470(5) . . no
P12 C114 3.583(4) . . no
P12 C105 3.389(4) . . no
P12 P13 3.5124(13) . . no
P12 C101 3.328(4) . . no
P13 P12 3.5124(13) . . no
P13 P14 3.6028(13) . . no
P14 P13 3.6028(13) . . no
P14 C117 3.645(4) . . no
P22 C201 3.327(4) . . no
P22 P23 3.5037(13) . . no
P22 C214 3.561(4) . . no
P22 C211 3.510(4) . . no
P22 C205 3.394(4) . . no
P23 P24 3.6125(13) . . no
P23 P22 3.5037(13) . . no
P24 C217 3.668(4) . . no
P24 P23 3.6125(13) . . no
P32 C314 3.599(4) . . no
P32 C311 3.468(4) . . no
P32 C305 3.391(4) . . no
P32 P33 3.5139(13) . . no
P32 C301 3.323(4) . . no
P33 P34 3.5984(13) . . no
P33 P32 3.5139(13) . . no
P34 P33 3.5984(13) . . no
P34 C317 3.634(4) . . no
P42 C401 3.327(4) . . no
P42 C405 3.395(4) . . no
P42 P43 3.5012(13) . . no
P42 C411 3.505(4) . . no
P42 C414 3.554(4) . . no
P43 P44 3.6136(13) . . no
P43 P42 3.5012(13) . . no
P44 P43 3.6136(13) . . no
P44 C417 3.662(4) . . no
P12 H11E 2.5600 . . no
P12 H10D 2.9800 . . no
P12 H11L 2.9300 . . no
P12 H10L 3.0100 . . no
P14 H11T 3.1500 . . no
P22 H20J 3.0100 . . no
P22 H21D 2.6000 . . no
P22 H21L 2.9500 . . no
P22 H20A 3.1500 . . no
P22 H20D 3.0000 . . no
P24 H21S 3.1800 . . no
P32 H31K 2.9900 . . no
P32 H30A 3.1800 . . no
P32 H30E 3.0200 . . no
P32 H30K 3.0100 . . no
P32 H31F 2.5500 . . no
P34 H31U 3.1700 . . no
P42 H40J 3.0300 . . no
P42 H40D 2.9800 . . no
P42 H41K 2.9200 . . no
P42 H41D 2.6000 . . no
P42 H40C 3.1700 . . no
P44 H41U 3.1800 . . no
C103 C107 3.554(6) . . no
C104 C108 3.404(5) . . no
C107 C103 3.554(6) . . no
C108 C124 3.566(5) . . no
C108 C125 3.588(5) . . no
C108 C104 3.404(5) . . no
C110 C210 3.532(6) . . no
C110 C116 3.360(6) . . no
C111 C114 3.481(6) . . no
C111 P12 3.470(5) . . no
C114 C111 3.481(6) . . no
C114 P12 3.583(4) . . no
C115 C131 3.465(6) . . no
C116 C110 3.360(6) . . no
C117 C123 3.551(5) . . no
C119 C121 3.569(6) . 3_656 no
C119 C135 3.254(5) . . no
C120 C120 3.512(6) . 3_656 no
C120 C121 3.353(6) . 3_656 no
C121 C120 3.353(6) . 3_656 no
C121 C119 3.569(6) . 3_656 no
C122 C220 3.557(6) . 7_556 no
C123 C117 3.551(5) . . no
C124 C108 3.566(5) . . no
C125 C108 3.588(5) . . no
C127 C219 3.564(5) . 5_545 no
C129 C131 3.222(6) . . no
C131 C115 3.465(6) . . no
C131 C129 3.222(6) . . no
C135 C119 3.254(5) . . no
C203 C207 3.511(6) . . no
C104 H31E 2.9600 . 2_655 no
C104 H10Q 2.6600 . . no
C104 H10O 2.9800 . . no
C204 C208 3.420(5) . . no
C105 H10I 3.0600 . . no
C107 H10I 2.9600 . . no
C207 C203 3.511(6) . . no
C107 H10E 2.8500 . . no
C108 H132 3.1000 . 2_655 no
C208 C224 3.547(5) . . no
C108 H10I 2.9900 . . no
C108 H31D 3.0800 . 2_655 no
C208 C204 3.420(5) . . no
C110 H11S 3.0500 . . no
C110 H11P 3.0800 . . no
C210 C216 3.396(6) . . no
C110 H11U 2.8200 . . no
C210 C110 3.532(6) . . no
C110 H222 2.9600 . 7_556 no
C110 H11R 2.9700 . . no
C111 H30P 3.0200 . 6_555 no
C211 C214 3.482(6) . . no
C211 P22 3.510(4) . . no
C111 H11J 2.8000 . . no
C112 H123 2.8500 . . no
C112 H11S 3.0700 . . no
C113 H11D 3.0900 . . no
C114 H11D 2.9800 . . no
C214 P22 3.561(4) . . no
C214 C211 3.482(6) . . no
C115 H10K 3.0500 . 2_655 no
C115 H11T 2.9100 . . no
C215 C231 3.532(6) . . no
C116 H11U 2.9000 . . no
C116 H21P 3.0500 . . no
C116 H11A 2.6300 . . no
C216 C210 3.396(6) . . no
C117 H11C 2.6000 . . no
C117 H11P 2.8900 . . no
C117 H11M 2.6700 . . no
C117 H11G 3.0700 . . no
C217 C223 3.452(5) . . no
C118 H135 2.8000 . . no
C118 H125 2.9700 . . no
C219 C225 3.550(5) . . no
C219 C235 3.256(5) . . no
C119 H135 2.6100 . . no
C219 C127 3.564(5) . 5_455 no
C120 H40D 3.0400 . 6_545 no
C220 C122 3.557(6) . 7_556 no
C123 H11S 2.8800 . . no
C223 C217 3.452(5) . . no
C123 H11G 2.9700 . . no
C124 H10P 2.7100 . . no
C124 H119 3.0200 . . no
C224 C208 3.547(5) . . no
C225 C219 3.550(5) . . no
C125 H10P 3.0100 . . no
C125 H10G 2.7000 . . no
C125 H121 2.8800 . 3_656 no
C126 H10G 2.8100 . . no
C126 H121 2.9100 . 3_656 no
C127 H219 2.8200 . 5_545 no
C128 H219 3.0900 . 5_545 no
C129 H10P 2.8500 . . no
C229 C231 3.265(5) . . no
C130 H11T 2.8200 . . no
C130 H129 2.6000 . . no
C130 H11N 3.0300 . . no
C231 C215 3.532(6) . . no
C131 H129 2.5400 . . no
C231 C229 3.265(5) . . no
C131 H11N 2.6400 . . no
C134 H40P 3.0000 . 6_545 no
C235 C219 3.256(5) . . no
C135 H119 2.9000 . . no
C135 H11T 2.7400 . . no
C201 H20O 3.0900 . . no
C303 C307 3.564(6) . . no
C203 H20O 3.0600 . . no
C204 H20Q 2.6700 . . no
C204 H41F 3.0100 . 2_555 no
C304 C308 3.411(6) . . no
C204 H20O 2.9800 . . no
C307 C303 3.564(6) . . no
C207 H20E 2.8200 . . no
C207 H20I 3.0200 . . no
C308 C324 3.579(5) . . no
C208 H20G 3.0900 . . no
C308 C304 3.411(6) . . no
C208 H20I 3.1000 . . no
C210 H21U 3.0000 . . no
C310 C316 3.353(6) . . no
C210 H21R 2.9800 . . no
C210 H21T 2.8200 . . no
C210 H11C 3.0800 . . no
C310 C410 3.520(5) . . no
C211 H21R 3.0700 . . no
C311 P32 3.468(4) . . no
C211 H40M 3.0300 . 6_545 no
C311 C314 3.476(6) . . no
C211 H21J 2.7800 . . no
C212 H223 2.8700 . . no
C213 H21F 3.0600 . . no
C314 C311 3.476(6) . . no
C314 P32 3.599(4) . . no
C214 H21F 2.9900 . . no
C215 H21S 2.8800 . . no
C215 H20L 3.0400 . 2_555 no
C315 C331 3.471(6) . . no
C216 H21F 3.0500 . . no
C216 H21T 2.8600 . . no
C216 H11P 3.0200 . . no
C316 C310 3.353(6) . . no
C216 H21A 2.6600 . . no
C317 C323 3.549(5) . . no
C217 H21M 2.6600 . . no
C217 H21P 2.8700 . . no
C217 H21C 2.6000 . . no
C217 H30D 2.9800 . 6_555 no
C218 H225 2.9600 . . no
C218 H235 2.7500 . . no
C319 C335 3.254(5) . . no
C219 H235 2.6200 . . no
C220 H30E 3.0900 . 6_555 no
C320 C321 3.366(6) . 3_555 no
C220 H122 3.0300 . 7_556 no
C320 C320 3.540(6) . 3_555 no
C321 C320 3.366(6) . 3_555 no
C222 H11C 3.0900 . 7_556 no
C322 C420 3.547(5) . 7_555 no
C323 C317 3.549(5) . . no
C223 H21H 3.0200 . . no
C223 H21U 2.7700 . . no
C324 C308 3.579(5) . . no
C224 H20P 2.7000 . . no
C224 H219 2.9100 . . no
C225 H20P 3.0800 . . no
C225 H20G 2.7300 . . no
C226 H20G 2.8600 . . no
C327 C419 3.572(6) . 5_445 no
C227 H119 2.8700 . 5_455 no
C229 H20P 2.7900 . . no
C329 C331 3.225(6) . . no
C230 H229 2.6200 . . no
C230 H21N 3.0300 . . no
C230 H21S 2.8900 . . no
C231 H21N 2.6800 . . no
C331 C329 3.225(6) . . no
C231 H229 2.5800 . . no
C331 C315 3.471(6) . . no
C234 H30O 3.0400 . 6_555 no
C335 C319 3.254(5) . . no
C235 H21S 2.7600 . . no
C235 H219 2.9500 . . no
C403 C408 3.519(6) . . no
C404 C407 3.423(6) . . no
C304 H30P 2.6700 . . no
C304 H11F 2.9500 . 6_545 no
C304 H30M 3.0000 . . no
C305 H30G 3.1000 . . no
C407 C404 3.423(6) . . no
C307 H30G 2.9800 . . no
C407 C424 3.546(5) . . no
C307 H30D 2.8500 . . no
C408 C403 3.519(6) . . no
C308 H30G 3.0300 . . no
C310 H31S 3.0700 . . no
C310 H31P 2.9200 . . no
C310 H422 2.9600 . 7_555 no
C410 C416 3.394(6) . . no
C310 H31T 2.7700 . . no
C410 C310 3.520(5) . . no
C311 H31P 3.0900 . . no
C411 C414 3.476(6) . . no
C411 P42 3.505(4) . . no
C311 H31J 2.7700 . . no
C311 H10Q 2.9700 . 2_655 no
C312 H323 2.8600 . . no
C312 H31S 3.0700 . . no
C313 H31D 3.0800 . . no
C414 C411 3.476(6) . . no
C314 H31D 2.9700 . . no
C414 P42 3.554(4) . . no
C315 H31U 2.8700 . . no
C415 C431 3.525(6) . . no
C315 H40K 3.0200 . 6_545 no
C316 H31D 3.0800 . . no
C316 H31T 2.9300 . . no
C416 C410 3.394(6) . . no
C316 H31A 2.6200 . . no
C316 H41P 3.0700 . . no
C317 H31B 2.5900 . . no
C317 H31G 3.0500 . . no
C417 C423 3.455(5) . . no
C317 H31R 2.9200 . . no
C317 H31N 2.6800 . . no
C317 H20E 3.0700 . 2_555 no
C318 H335 2.8000 . . no
C318 H325 2.9700 . . no
C419 C435 3.255(5) . . no
C419 C425 3.542(5) . . no
C319 H335 2.6100 . . no
C419 C327 3.572(6) . 5_555 no
C320 H20D 3.0400 . 2_555 no
C323 H31G 2.9600 . . no
C323 H31S 2.8500 . . no
C423 C417 3.455(5) . . no
C324 H30Q 2.7200 . . no
C324 H319 3.0200 . . no
C424 C407 3.546(5) . . no
C425 C419 3.542(5) . . no
C325 H321 2.9100 . 3_555 no
C325 H30I 2.7000 . . no
C325 H30Q 3.0200 . . no
C326 H30I 2.8200 . . no
C326 H321 2.9300 . 3_555 no
C327 H419 2.8200 . 5_445 no
C328 H419 3.0800 . 5_445 no
C429 C431 3.261(5) . . no
C329 H432 3.1000 . 6_545 no
C329 H30Q 2.8600 . . no
C330 H31U 2.8400 . . no
C330 H329 2.6000 . . no
C330 H31M 3.0300 . . no
C431 C415 3.525(6) . . no
C331 H31M 2.6400 . . no
C431 C429 3.261(5) . . no
C331 H329 2.5500 . . no
C334 H20M 2.9900 . 2_555 no
C335 H31U 2.7400 . . no
C335 H319 2.9000 . . no
C435 C419 3.255(5) . . no
C401 H40Q 3.0900 . . no
C403 H40Q 3.0600 . . no
C404 H40Q 2.9900 . . no
C404 H40M 2.6500 . . no
C404 H21E 3.0200 . 6_555 no
C407 H40H 3.0700 . . no
C408 H40H 3.0100 . . no
C408 H40F 2.8300 . . no
C409 H41Q 3.0900 . . no
C410 H41Q 2.9500 . . no
C410 H31B 3.0700 . . no
C410 H41S 3.0200 . . no
C410 H41T 2.8100 . . no
C411 H41Q 3.0700 . . no
C411 H41J 2.7800 . . no
C411 H20Q 3.0500 . 2_555 no
C412 H10H 3.0900 . 8_454 no
C412 H423 2.8600 . . no
C413 H41E 3.0600 . . no
C414 H41E 2.9800 . . no
C415 H41U 2.8900 . . no
C415 H30L 3.0400 . 6_555 no
C416 H31R 3.0100 . . no
C416 H41T 2.8900 . . no
C416 H41C 2.6600 . . no
C416 H41E 3.0500 . . no
C417 H41P 2.8900 . . no
C417 H41A 2.6000 . . no
C417 H41M 2.7000 . . no
C417 H10E 2.9700 . 2_655 no
C418 H425 2.9400 . . no
C418 H435 2.7400 . . no
C419 H435 2.6300 . . no
C423 H41S 2.7600 . . no
C423 H41G 3.0000 . . no
C424 H40N 2.7300 . . no
C424 H419 2.9100 . . no
C425 H40G 2.7200 . . no
C426 H40G 2.8500 . . no
C427 H319 2.8500 . 5_555 no
C429 H40N 2.8000 . . no
C430 H41U 2.8900 . . no
C430 H41O 3.0300 . . no
C430 H429 2.6300 . . no
C431 H429 2.5800 . . no
C431 H41O 2.6700 . . no
C434 H10M 3.0400 . 2_655 no
C435 H419 2.9500 . . no
C435 H41U 2.7600 . . no
H10A Pt1 3.2900 . . no
H10A H10G 2.5600 . . no
H10A H125 2.4300 . . no
H10B Pt1 3.4400 . . no
H10B H10D 2.4600 . . no
H10C H10F 2.5100 . . no
H10C H10H 2.4600 . . no
H10D H10B 2.4600 . . no
H10D P12 2.9800 . . no
H10E C417 2.9700 . 2_655 no
H10E C107 2.8500 . . no
H10E H10O 2.3700 . . no
H10E H10I 2.5100 . . no
H10F H10H 2.4900 . . no
H10F H10C 2.5100 . . no
H10G H125 2.3800 . . no
H10G C125 2.7000 . . no
H10G C126 2.8100 . . no
H10G H10A 2.5600 . . no
H10G H10Q 2.3800 . . no
H10H H41I 2.4200 . 8_555 no
H10H H10C 2.4600 . . no
H10H H10F 2.4900 . . no
H10H C412 3.0900 . 8_555 no
H10I H31E 2.5900 . 2_655 no
H10I H10E 2.5100 . . no
H10I C108 2.9900 . . no
H10I H10Q 2.2200 . . no
H10I C105 3.0600 . . no
H10I H10O 2.1800 . . no
H10I C107 2.9600 . . no
H10J H10P 2.4800 . . no
H10J Pt1 3.1100 . . no
H10K H11N 2.5700 . 2_655 no
H10K H10R 2.4600 . . no
H10K H10N 2.4900 . . no
H10K C115 3.0500 . 2_655 no
H10L H10M 2.5200 . . no
H10L P12 3.0100 . . no
H10M H10L 2.5200 . . no
H10M C434 3.0400 . 2_655 no
H10N H11O 2.5000 . 2_655 no
H10N H10K 2.4900 . . no
H10N H10R 2.5300 . . no
H10O H10Q 2.5300 . . no
H10O H10E 2.3700 . . no
H10O H10I 2.1800 . . no
H10O C104 2.9800 . . no
H10P C129 2.8500 . . no
H10P C125 3.0100 . . no
H10P H10J 2.4800 . . no
H10P C124 2.7100 . . no
H10Q C104 2.6600 . . no
H10Q H10G 2.3800 . . no
H10Q C311 2.9700 . 2_655 no
H10Q H10I 2.2200 . . no
H10Q H10O 2.5300 . . no
H10Q H31D 2.3800 . 2_655 no
H10R H10N 2.5300 . . no
H10R H10K 2.4600 . . no
H11A H11P 2.3900 . . no
H11A H11R 2.1600 . . no
H11A H11D 2.4900 . . no
H11A C116 2.6300 . . no
H11B H11H 2.4500 . . no
H11B H222 2.5300 . 7_556 no
H11B H11F 2.4800 . . no
H11C C210 3.0800 . . no
H11C H11G 2.4800 . . no
H11C H222 2.5200 . 7_556 no
H11C H11S 2.4000 . . no
H11C C117 2.6000 . . no
H11C C222 3.0900 . 7_556 no
H11C H11U 2.2900 . . no
H11D H11R 2.3900 . . no
H11D H30P 2.3700 . 6_555 no
H11D H11A 2.4900 . . no
H11D H11J 2.2000 . . no
H11D C114 2.9800 . . no
H11D C113 3.0900 . . no
H11E H11I 2.5600 . . no
H11E P12 2.5600 . . no
H11E Pt1 3.6200 . . no
H11F C304 2.9500 . 6_555 no
H11F H11H 2.4200 . . no
H11F H11B 2.4800 . . no
H11G H123 2.3000 . . no
H11G H11C 2.4800 . . no
H11G C117 3.0700 . . no
H11G C123 2.9700 . . no
H11G H11S 2.4400 . . no
H11H H11B 2.4500 . . no
H11H H11F 2.4200 . . no
H11I Pt1 3.0500 . . no
H11I H11E 2.5600 . . no
H11I H123 2.5700 . . no
H11J H11D 2.2000 . . no
H11J C111 2.8000 . . no
H11J H11R 2.4600 . . no
H11K H11Q 2.5600 . . no
H11K H11O 2.4200 . . no
H11L P12 2.9300 . . no
H11L Pt1 3.1900 . . no
H11L H11N 2.5600 . . no
H11M C117 2.6700 . . no
H11M H11T 2.3200 . . no
H11M H11P 2.5200 . . no
H11N H10K 2.5700 . 2_655 no
H11N H11L 2.5600 . . no
H11N C131 2.6400 . . no
H11N Pt1 3.2800 . . no
H11N C130 3.0300 . . no
H11O H11Q 2.4300 . . no
H11O H11K 2.4200 . . no
H11O H10N 2.5000 . 2_655 no
H11P C117 2.8900 . . no
H11P C216 3.0200 . . no
H11P H11A 2.3900 . . no
H11P C110 3.0800 . . no
H11P H11U 2.2000 . . no
H11P H21P 2.5400 . . no
H11P H11M 2.5200 . . no
H11Q H11K 2.5600 . . no
H11Q H11O 2.4300 . . no
H11R H11D 2.3900 . . no
H11R H11A 2.1600 . . no
H11R H11J 2.4600 . . no
H11R C110 2.9700 . . no
H11S C110 3.0500 . . no
H11S C123 2.8800 . . no
H11S H11C 2.4000 . . no
H11S H11G 2.4400 . . no
H11S C112 3.0700 . . no
H11T H11M 2.3200 . . no
H11T P14 3.1500 . . no
H11T C130 2.8200 . . no
H11T C135 2.7400 . . no
H11T C115 2.9100 . . no
H11U C110 2.8200 . . no
H11U C116 2.9000 . . no
H11U H11P 2.2000 . . no
H11U H11C 2.2900 . . no
H20A Pt2 3.4100 . . no
H20A P22 3.1500 . . no
H20A H20D 2.4900 . . no
H20A H21G 2.5200 . . no
H20B H20H 2.4200 . . no
H20B H20F 2.4900 . . no
H20C H225 2.5300 . . no
H20C H20G 2.6000 . . no
H20C Pt2 3.2800 . . no
H20D H20A 2.4900 . . no
H20D P22 3.0000 . . no
H20D C320 3.0400 . 2_555 no
H20E H20I 2.4700 . . no
H20E H20M 2.5900 . . no
H20E C207 2.8200 . . no
H20E H20O 2.3100 . . no
H20E C317 3.0700 . 2_555 no
H20F H20B 2.4900 . . no
H20F H20H 2.5700 . . no
H20F H420 2.5400 . 8_455 no
H20G H20C 2.6000 . . no
H20G H225 2.4700 . . no
H20G H20Q 2.3100 . . no
H20G C208 3.0900 . . no
H20G C225 2.7300 . . no
H20G C226 2.8600 . . no
H20H H20B 2.4200 . . no
H20H H20F 2.5700 . . no
H20H H421 2.5600 . 8_455 no
H20I H20O 2.2200 . . no
H20I H20Q 2.3200 . . no
H20I H20E 2.4700 . . no
H20I C207 3.0200 . . no
H20I C208 3.1000 . . no
H20J H20M 2.5200 . . no
H20J P22 3.0100 . . no
H20K H20P 2.4800 . . no
H20K H231 2.5800 . . no
H20K Pt2 3.1500 . . no
H20L H20N 2.5100 . . no
H20L H21N 2.5700 . 2_555 no
H20L H20R 2.4700 . . no
H20L C215 3.0400 . 2_555 no
H20M H20E 2.5900 . . no
H20M C334 2.9900 . 2_555 no
H20M H20J 2.5200 . . no
H20N H20L 2.5100 . . no
H20N H20R 2.5400 . . no
H20N H21O 2.5700 . 2_555 no
H20O C201 3.0900 . . no
H20O H20Q 2.5400 . . no
H20O H20I 2.2200 . . no
H20O H20E 2.3100 . . no
H20O C203 3.0600 . . no
H20O C204 2.9800 . . no
H20P C225 3.0800 . . no
H20P C229 2.7900 . . no
H20P H20K 2.4800 . . no
H20P C224 2.7000 . . no
H20Q H20G 2.3100 . . no
H20Q H20I 2.3200 . . no
H20Q C204 2.6700 . . no
H20Q C411 3.0500 . 2_555 no
H20Q H41E 2.4500 . 2_555 no
H20Q H20O 2.5400 . . no
H20R H20N 2.5400 . . no
H20R H20L 2.4700 . . no
H21A C216 2.6600 . . no
H21A H21F 2.5100 . . no
H21A H21R 2.1800 . . no
H21A H21P 2.4200 . . no
H21B H21E 2.4800 . . no
H21B H21I 2.4700 . . no
H21C C217 2.6000 . . no
H21C H21U 2.3500 . . no
H21C H21T 2.3500 . . no
H21C H21H 2.4500 . . no
H21D H21G 2.5700 . . no
H21D Pt2 3.6500 . . no
H21D P22 2.6000 . . no
H21E H21B 2.4800 . . no
H21E C404 3.0200 . 6_545 no
H21E H21I 2.4100 . . no
H21F H21J 2.2100 . . no
H21F H40M 2.4800 . 6_545 no
H21F H21A 2.5100 . . no
H21F C216 3.0500 . . no
H21F C214 2.9900 . . no
H21F H21R 2.3000 . . no
H21F C213 3.0600 . . no
H21G H20A 2.5200 . . no
H21G H21D 2.5700 . . no
H21G Pt2 3.0200 . . no
H21H H21C 2.4500 . . no
H21H C223 3.0200 . . no
H21H H223 2.2300 . . no
H21H H21U 2.5300 . . no
H21I H30H 2.4800 . 4_555 no
H21I H21B 2.4700 . . no
H21I H21E 2.4100 . . no
H21J H21R 2.5000 . . no
H21J C211 2.7800 . . no
H21J H21F 2.2100 . . no
H21K H21Q 2.5000 . . no
H21K H21O 2.4200 . . no
H21L H21N 2.5500 . . no
H21L Pt2 3.2500 . . no
H21L P22 2.9500 . . no
H21M C217 2.6600 . . no
H21M H21T 2.5800 . . no
H21M H21P 2.5100 . . no
H21M H21S 2.3100 . . no
H21N Pt2 3.3000 . . no
H21N H20L 2.5700 . 2_555 no
H21N H21L 2.5500 . . no
H21N C231 2.6800 . . no
H21N C230 3.0300 . . no
H21O H20N 2.5700 . 2_555 no
H21O H21Q 2.4700 . . no
H21O H21K 2.4200 . . no
H21P C116 3.0500 . . no
H21P H21A 2.4200 . . no
H21P H11P 2.5400 . . no
H21P H21M 2.5100 . . no
H21P C217 2.8700 . . no
H21P H21T 2.1700 . . no
H21Q H21K 2.5000 . . no
H21Q H21O 2.4700 . . no
H21R H21F 2.3000 . . no
H21R H21A 2.1800 . . no
H21R C211 3.0700 . . no
H21R H21J 2.5000 . . no
H21R C210 2.9800 . . no
H21S C235 2.7600 . . no
H21S C230 2.8900 . . no
H21S C215 2.8800 . . no
H21S P24 3.1800 . . no
H21S H21M 2.3100 . . no
H21T C210 2.8200 . . no
H21T C216 2.8600 . . no
H21T H21M 2.5800 . . no
H21T H21C 2.3500 . . no
H21T H21P 2.1700 . . no
H21U H223 2.5400 . . no
H21U H21C 2.3500 . . no
H21U C210 3.0000 . . no
H21U C223 2.7700 . . no
H21U H21H 2.5300 . . no
H30A P32 3.1800 . . no
H30A Pt3 3.4000 . . no
H30A H30E 2.4600 . . no
H30B H325 2.4300 . . no
H30B Pt3 3.3400 . . no
H30B H30I 2.5500 . . no
H30C H30F 2.4800 . . no
H30C H30H 2.4600 . . no
H30D H30M 2.4000 . . no
H30D H30O 2.5800 . . no
H30D H30G 2.5100 . . no
H30D C217 2.9800 . 6_545 no
H30D C307 2.8500 . . no
H30E P32 3.0200 . . no
H30E H30A 2.4600 . . no
H30E C220 3.0900 . 6_545 no
H30F H30H 2.4900 . . no
H30F H30C 2.4800 . . no
H30G C308 3.0300 . . no
H30G C307 2.9800 . . no
H30G C305 3.1000 . . no
H30G H30P 2.2600 . . no
H30G H30M 2.2000 . . no
H30G H30D 2.5100 . . no
H30H H21I 2.4800 . 4_554 no
H30H H30C 2.4600 . . no
H30H H30F 2.4900 . . no
H30I H30B 2.5500 . . no
H30I H30P 2.3500 . . no
H30I H325 2.4000 . . no
H30I C325 2.7000 . . no
H30I C326 2.8200 . . no
H30J H30Q 2.4900 . . no
H30J Pt3 3.1300 . . no
H30K P32 3.0100 . . no
H30K H30O 2.5300 . . no
H30L H30R 2.4600 . . no
H30L H30N 2.4800 . . no
H30L C415 3.0400 . 6_545 no
H30L H41O 2.5900 . 6_545 no
H30M H30G 2.2000 . . no
H30M H30P 2.5200 . . no
H30M C304 3.0000 . . no
H30M H30D 2.4000 . . no
H30N H30R 2.5500 . . no
H30N H41N 2.5100 . 6_545 no
H30N H30L 2.4800 . . no
H30O C234 3.0400 . 6_545 no
H30O H30D 2.5800 . . no
H30O H30K 2.5300 . . no
H30P H30M 2.5200 . . no
H30P H30I 2.3500 . . no
H30P C111 3.0200 . 6_545 no
H30P C304 2.6700 . . no
H30P H30G 2.2600 . . no
H30P H11D 2.3700 . 6_545 no
H30Q H30J 2.4900 . . no
H30Q C329 2.8600 . . no
H30Q C324 2.7200 . . no
H30Q C325 3.0200 . . no
H30R H30L 2.4600 . . no
H30R H30N 2.5500 . . no
H31A H31D 2.4900 . . no
H31A H31R 2.4200 . . no
H31A C316 2.6200 . . no
H31A H31P 2.1100 . . no
H31B H31T 2.2500 . . no
H31B H31S 2.4300 . . no
H31B C422 3.0900 . 7_555 no
H31B H422 2.5200 . 7_555 no
H31B C317 2.5900 . . no
H31B C410 3.0700 . . no
H31B H31G 2.4900 . . no
H31C H422 2.5400 . 7_555 no
H31C H31E 2.5000 . . no
H31C H31I 2.4500 . . no
H31D C108 3.0800 . 2_655 no
H31D H31J 2.1900 . . no
H31D H31P 2.3400 . . no
H31D C313 3.0800 . . no
H31D C314 2.9700 . . no
H31D C316 3.0800 . . no
H31D H31A 2.4900 . . no
H31D H10Q 2.3800 . 2_655 no
H31E H31I 2.4400 . . no
H31E C104 2.9600 . 2_655 no
H31E H31C 2.5000 . . no
H31E H10I 2.5900 . 2_655 no
H31F H31H 2.5700 . . no
H31F P32 2.5500 . . no
H31F Pt3 3.6100 . . no
H31G C323 2.9600 . . no
H31G H31B 2.4900 . . no
H31G H323 2.2800 . . no
H31G H31S 2.4300 . . no
H31G C317 3.0500 . . no
H31H Pt3 3.0600 . . no
H31H H31F 2.5700 . . no
H31I H31E 2.4400 . . no
H31I H31C 2.4500 . . no
H31J H31D 2.1900 . . no
H31J C311 2.7700 . . no
H31J H31P 2.4900 . . no
H31K H31M 2.5300 . . no
H31K P32 2.9900 . . no
H31K Pt3 3.2200 . . no
H31L H31Q 2.4800 . . no
H31L H31O 2.4300 . . no
H31M H31K 2.5300 . . no
H31M Pt3 3.2900 . . no
H31M C331 2.6400 . . no
H31M C330 3.0300 . . no
H31M H40K 2.5400 . 6_545 no
H31N C317 2.6800 . . no
H31N H31R 2.5000 . . no
H31N H31U 2.2900 . . no
H31O H40R 2.5300 . 6_545 no
H31O H31L 2.4300 . . no
H31O H31Q 2.4600 . . no
H31P C310 2.9200 . . no
H31P C311 3.0900 . . no
H31P H31A 2.1100 . . no
H31P H31J 2.4900 . . no
H31P H31D 2.3400 . . no
H31Q H31O 2.4600 . . no
H31Q H31L 2.4800 . . no
H31R H41P 2.5600 . . no
H31R H31T 2.2500 . . no
H31R H31A 2.4200 . . no
H31R H31N 2.5000 . . no
H31R C317 2.9200 . . no
H31R C416 3.0100 . . no
H31S C312 3.0700 . . no
H31S C310 3.0700 . . no
H31S C323 2.8500 . . no
H31S H31G 2.4300 . . no
H31S H31B 2.4300 . . no
H31T H31B 2.2500 . . no
H31T H31R 2.2500 . . no
H31T C316 2.9300 . . no
H31T C310 2.7700 . . no
H31U C335 2.7400 . . no
H31U P34 3.1700 . . no
H31U C315 2.8700 . . no
H31U H31N 2.2900 . . no
H31U C330 2.8400 . . no
H40A Pt4 3.2700 . . no
H40A H40G 2.5900 . . no
H40A H425 2.5400 . . no
H40B H40I 2.4200 . . no
H40B H40E 2.4900 . . no
H40C H40D 2.4800 . . no
H40C P42 3.1700 . . no
H40C H41H 2.5400 . . no
H40C Pt4 3.4300 . . no
H40D H40C 2.4800 . . no
H40D P42 2.9800 . . no
H40E H40B 2.4900 . . no
H40E H40I 2.5600 . . no
H40F H40Q 2.3000 . . no
H40F C408 2.8300 . . no
H40F H40H 2.4600 . . no
H40G C426 2.8500 . . no
H40G H425 2.4600 . . no
H40G H40A 2.5900 . . no
H40G C425 2.7200 . . no
H40G H40M 2.3000 . . no
H40H C408 3.0100 . . no
H40H H40Q 2.2200 . . no
H40H H40F 2.4600 . . no
H40H H40M 2.2900 . . no
H40H C407 3.0700 . . no
H40I H40E 2.5600 . . no
H40I H40B 2.4200 . . no
H40J P42 3.0300 . . no
H40J H40P 2.5200 . . no
H40K H40R 2.5300 . . no
H40K H40O 2.5000 . . no
H40K C315 3.0200 . 6_555 no
H40K H31M 2.5400 . 6_555 no
H40L H431 2.6000 . . no
H40L H40N 2.4600 . . no
H40L Pt4 3.1300 . . no
H40M H40H 2.2900 . . no
H40M H40Q 2.5700 . . no
H40M C211 3.0300 . 6_555 no
H40M C404 2.6500 . . no
H40M H21F 2.4800 . 6_555 no
H40M H40G 2.3000 . . no
H40N C424 2.7300 . . no
H40N C429 2.8000 . . no
H40N H40L 2.4600 . . no
H40O H40R 2.4800 . . no
H40O H40K 2.5000 . . no
H40P H40J 2.5200 . . no
H40Q H40H 2.2200 . . no
H40Q C403 3.0600 . . no
H40Q C401 3.0900 . . no
H40Q H40M 2.5700 . . no
H40Q H40F 2.3000 . . no
H40Q C404 2.9900 . . no
H40R H31O 2.5300 . 6_555 no
H40R H40O 2.4800 . . no
H40R H40K 2.5300 . . no
H41A H41G 2.4500 . . no
H41A H41T 2.3200 . . no
H41A C417 2.6000 . . no
H41A H41S 2.3700 . . no
H41B H41F 2.4800 . . no
H41B H41I 2.4600 . . no
H41C H41Q 2.1500 . . no
H41C C416 2.6600 . . no
H41C H41E 2.5100 . . no
H41C H41P 2.4500 . . no
H41D H41H 2.5500 . . no
H41D P42 2.6000 . . no
H41D Pt4 3.6500 . . no
H41E H41J 2.2100 . . no
H41E H41C 2.5100 . . no
H41E H41Q 2.3100 . . no
H41E C416 3.0500 . . no
H41E C413 3.0600 . . no
H41E H20Q 2.4500 . 2_555 no
H41E C414 2.9800 . . no
H41F H41I 2.4100 . . no
H41F H41B 2.4800 . . no
H41F C204 3.0100 . 2_555 no
H41G H423 2.2200 . . no
H41G H41A 2.4500 . . no
H41G C423 3.0000 . . no
H41G H41S 2.5100 . . no
H41H H41D 2.5500 . . no
H41H H40C 2.5400 . . no
H41H Pt4 3.0200 . . no
H41I H10H 2.4200 . 8_454 no
H41I H41B 2.4600 . . no
H41I H41F 2.4100 . . no
H41J H41Q 2.5000 . . no
H41J H41E 2.2100 . . no
H41J C411 2.7800 . . no
H41K Pt4 3.2300 . . no
H41K P42 2.9200 . . no
H41K H41O 2.5600 . . no
H41L H41R 2.5000 . . no
H41L H41N 2.4100 . . no
H41M C417 2.7000 . . no
H41M H41P 2.4800 . . no
H41M H41U 2.3300 . . no
H41N H41L 2.4100 . . no
H41N H41R 2.4900 . . no
H41N H30N 2.5100 . 6_555 no
H41O C430 3.0300 . . no
H41O H30L 2.5900 . 6_555 no
H41O H41K 2.5600 . . no
H41O C431 2.6700 . . no
H41O Pt4 3.2800 . . no
H41P C316 3.0700 . . no
H41P C417 2.8900 . . no
H41P H31R 2.5600 . . no
H41P H41C 2.4500 . . no
H41P H41T 2.2000 . . no
H41P H41M 2.4800 . . no
H41Q H41E 2.3100 . . no
H41Q H41C 2.1500 . . no
H41Q H41J 2.5000 . . no
H41Q C409 3.0900 . . no
H41Q C411 3.0700 . . no
H41Q C410 2.9500 . . no
H41R H41N 2.4900 . . no
H41R H41L 2.5000 . . no
H41S H41G 2.5100 . . no
H41S H423 2.5400 . . no
H41S H41A 2.3700 . . no
H41S C410 3.0200 . . no
H41S C423 2.7600 . . no
H41T C410 2.8100 . . no
H41T H41P 2.2000 . . no
H41T H41A 2.3200 . . no
H41T C416 2.8900 . . no
H41U C435 2.7600 . . no
H41U H41M 2.3300 . . no
H41U C415 2.8900 . . no
H41U C430 2.8900 . . no
H41U P44 3.1800 . . no
H119 C124 3.0200 . . no
H119 C227 2.8700 . 5_545 no
H119 C135 2.9000 . . no
H119 H135 2.3900 . . no
H121 C125 2.8800 . 3_656 no
H121 C126 2.9100 . 3_656 no
H122 C220 3.0300 . 7_556 no
H123 Pt1 2.9700 . . no
H123 H11I 2.5700 . . no
H123 H11G 2.3000 . . no
H123 C112 2.8500 . . no
H125 C118 2.9700 . . no
H125 H10G 2.3800 . . no
H125 H10A 2.4300 . . no
H129 C131 2.5400 . . no
H129 C130 2.6000 . . no
H131 Pt1 3.5100 . . no
H132 C108 3.1000 . 2_655 no
H135 C119 2.6100 . . no
H135 H119 2.3900 . . no
H135 C118 2.8000 . . no
H219 C224 2.9100 . . no
H219 C127 2.8200 . 5_455 no
H219 C128 3.0900 . 5_455 no
H219 C235 2.9500 . . no
H219 H235 2.4800 . . no
H220 H40E 2.5100 . 4_565 no
H221 H40I 2.5500 . 4_565 no
H222 H11C 2.5200 . 7_556 no
H222 C110 2.9600 . 7_556 no
H222 H11B 2.5300 . 7_556 no
H223 H21H 2.2300 . . no
H223 C212 2.8700 . . no
H223 H21U 2.5400 . . no
H223 Pt2 3.0700 . . no
H225 C218 2.9600 . . no
H225 H20C 2.5300 . . no
H225 H20G 2.4700 . . no
H229 C231 2.5800 . . no
H229 C230 2.6200 . . no
H231 H20K 2.5800 . . no
H231 Pt2 3.4900 . . no
H235 C218 2.7500 . . no
H235 C219 2.6200 . . no
H235 H219 2.4800 . . no
H319 C427 2.8500 . 5_445 no
H319 H335 2.3900 . . no
H319 C335 2.9000 . . no
H319 C324 3.0200 . . no
H321 C325 2.9100 . 3_555 no
H321 C326 2.9300 . 3_555 no
H322 C420 3.0300 . 7_555 no
H323 H31G 2.2800 . . no
H323 Pt3 2.9800 . . no
H323 C312 2.8600 . . no
H325 C318 2.9700 . . no
H325 H30B 2.4300 . . no
H325 H30I 2.4000 . . no
H329 C330 2.6000 . . no
H329 C331 2.5500 . . no
H331 Pt3 3.4900 . . no
H335 H319 2.3900 . . no
H335 C318 2.8000 . . no
H335 C319 2.6100 . . no
H419 C424 2.9100 . . no
H419 C435 2.9500 . . no
H419 H435 2.4800 . . no
H419 C327 2.8200 . 5_555 no
H419 C328 3.0800 . 5_555 no
H423 Pt4 3.0600 . . no
H423 C412 2.8600 . . no
H423 H41G 2.2200 . . no
H423 H41S 2.5400 . . no
H425 C418 2.9400 . . no
H425 H40A 2.5400 . . no
H425 H40G 2.4600 . . no
H429 C430 2.6300 . . no
H429 C431 2.5800 . . no
H431 Pt4 3.4900 . . no
H431 H40L 2.6000 . . no
H432 C329 3.1000 . 6_555 no
H435 C418 2.7400 . . no
H435 C419 2.6300 . . no
H435 H419 2.4800 . . no
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
C111 H11E P12 . 0.98 2.56 3.470(5) 155 yes
C211 H21D P22 . 0.98 2.60 3.510(4) 154 yes
C311 H31F P32 . 0.98 2.55 3.468(4) 155 yes
C411 H41D P42 . 0.98 2.60 3.505(4) 154 yes
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_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
P14 Pt1 P13 C117 . . . . 11.87(14) yes
P24 Pt2 P23 C217 . . . . 11.40(15) yes
P34 Pt3 P33 C317 . . . . -12.09(15) yes
P44 Pt4 P43 C417 . . . . -11.70(14) yes
P12 Pt1 P11 C101 . . . . 103.37(14) no
P12 Pt1 P11 C105 . . . . -109.41(14) no
P13 Pt1 P11 P12 . . . . -5.47(8) no
P13 Pt1 P11 C101 . . . . 97.90(15) no
P13 Pt1 P11 C105 . . . . -114.88(14) no
P14 Pt1 P11 P12 . . . . 178.15(4) no
P14 Pt1 P11 C101 . . . . -78.48(14) no
P14 Pt1 P11 C105 . . . . 68.74(14) no
P13 Pt1 P12 P11 . . . . 177.02(4) no
P11 Pt1 P13 C109 . . . . -49.45(15) no
P11 Pt1 P13 C113 . . . . 79.07(15) no
P11 Pt1 P13 C117 . . . . -164.67(14) no
P12 Pt1 P13 C109 . . . . -53.76(13) no
P12 Pt1 P13 C113 . . . . 74.76(14) no
P12 Pt1 P13 C117 . . . . -168.98(14) no
P14 Pt1 P13 C109 . . . . 127.09(13) no
P14 Pt1 P13 C113 . . . . -104.39(14) no
P11 Pt1 P14 C118 . . . . 111.04(13) no
P11 Pt1 P14 C124 . . . . -6.10(14) no
P11 Pt1 P14 C130 . . . . -125.31(13) no
P13 Pt1 P14 C118 . . . . -66.95(13) no
P13 Pt1 P14 C124 . . . . 175.91(14) no
P13 Pt1 P14 C130 . . . . 56.70(14) no
P22 Pt2 P23 C217 . . . . -171.22(14) no
P24 Pt2 P23 C209 . . . . 126.91(13) no
P24 Pt2 P23 C213 . . . . -104.63(14) no
P21 Pt2 P24 C218 . . . . 113.98(13) no
P21 Pt2 P24 C224 . . . . -2.39(15) no
P21 Pt2 P24 C230 . . . . -123.10(13) no
P23 Pt2 P24 C218 . . . . -64.18(13) no
P23 Pt2 P24 C224 . . . . 179.46(15) no
P23 Pt2 P24 C230 . . . . 58.75(13) no
P23 Pt2 P22 P21 . . . . 175.97(4) no
P21 Pt2 P23 C209 . . . . -49.95(15) no
P21 Pt2 P23 C213 . . . . 78.51(15) no
P21 Pt2 P23 C217 . . . . -165.46(14) no
P22 Pt2 P23 C209 . . . . -55.72(13) no
P22 Pt2 P23 C213 . . . . 72.75(14) no
P24 Pt2 P21 C201 . . . . -80.70(14) no
P22 Pt2 P21 C201 . . . . 103.34(14) no
P22 Pt2 P21 C205 . . . . -109.42(14) no
P23 Pt2 P21 P22 . . . . -7.33(8) no
P23 Pt2 P21 C201 . . . . 96.02(15) no
P23 Pt2 P21 C205 . . . . -116.75(14) no
P24 Pt2 P21 P22 . . . . 175.96(4) no
P24 Pt2 P21 C205 . . . . 66.54(13) no
P33 Pt3 P34 C324 . . . . -176.66(14) no
P34 Pt3 P33 C313 . . . . 104.24(14) no
P31 Pt3 P34 C318 . . . . -111.07(12) no
P31 Pt3 P34 C324 . . . . 5.55(14) no
P31 Pt3 P34 C330 . . . . 125.25(13) no
P33 Pt3 P34 C318 . . . . 66.72(12) no
P34 Pt3 P31 C301 . . . . 78.87(16) no
P34 Pt3 P31 C305 . . . . -68.64(14) no
P33 Pt3 P32 P31 . . . . -176.69(4) no
P31 Pt3 P33 C309 . . . . 48.93(16) no
P31 Pt3 P33 C313 . . . . -79.57(15) no
P31 Pt3 P33 C317 . . . . 164.10(14) no
P32 Pt3 P33 C309 . . . . 53.72(14) no
P32 Pt3 P33 C313 . . . . -74.78(14) no
P32 Pt3 P33 C317 . . . . 168.89(14) no
P34 Pt3 P33 C309 . . . . -127.26(14) no
P33 Pt3 P31 P32 . . . . 6.08(8) no
P32 Pt3 P31 C301 . . . . -103.22(16) no
P32 Pt3 P31 C305 . . . . 109.28(14) no
P34 Pt3 P31 P32 . . . . -177.91(4) no
P33 Pt3 P31 C301 . . . . -97.14(16) no
P33 Pt3 P31 C305 . . . . 115.35(14) no
P33 Pt3 P34 C330 . . . . -56.96(13) no
P44 Pt4 P43 C409 . . . . -126.81(13) no
P44 Pt4 P43 C413 . . . . 104.61(14) no
P43 Pt4 P42 P41 . . . . -176.13(4) no
P41 Pt4 P44 C418 . . . . -113.59(12) no
P41 Pt4 P44 C424 . . . . 3.26(15) no
P41 Pt4 P44 C430 . . . . 123.33(13) no
P43 Pt4 P44 C418 . . . . 64.60(13) no
P43 Pt4 P44 C424 . . . . -178.56(15) no
P43 Pt4 P44 C430 . . . . -58.49(13) no
P41 Pt4 P43 C409 . . . . 50.10(15) no
P41 Pt4 P43 C413 . . . . -78.49(15) no
P41 Pt4 P43 C417 . . . . 165.21(14) no
P42 Pt4 P43 C409 . . . . 55.64(13) no
P42 Pt4 P43 C413 . . . . -72.95(14) no
P42 Pt4 P43 C417 . . . . 170.75(14) no
P44 Pt4 P41 P42 . . . . -176.19(4) no
P44 Pt4 P41 C401 . . . . 80.42(15) no
P42 Pt4 P41 C401 . . . . -103.39(15) no
P42 Pt4 P41 C405 . . . . 109.45(14) no
P43 Pt4 P41 P42 . . . . 7.03(8) no
P43 Pt4 P41 C401 . . . . -96.36(15) no
P43 Pt4 P41 C405 . . . . 116.48(14) no
P44 Pt4 P41 C405 . . . . -66.74(14) no
C101 P11 P12 Pt1 . . . . -116.24(13) no
C105 P11 C101 C104 . . . . -37.1(3) no
C105 P11 P12 Pt1 . . . . 110.96(13) no
Pt1 P11 C105 C107 . . . . 158.0(2) no
Pt1 P11 C105 C108 . . . . -78.1(3) no
P12 P11 C105 C106 . . . . -37.2(3) no
P12 P11 C105 C107 . . . . 81.5(3) no
P12 P11 C105 C108 . . . . -154.5(2) no
C101 P11 C105 C106 . . . . -170.4(2) no
Pt1 P11 C105 C106 . . . . 39.3(3) no
C101 P11 C105 C108 . . . . 72.2(3) no
Pt1 P11 C101 C104 . . . . 112.0(3) no
P12 P11 C101 C102 . . . . 66.4(3) no
P12 P11 C101 C103 . . . . -49.9(3) no
P12 P11 C101 C104 . . . . -172.4(2) no
C105 P11 C101 C102 . . . . -158.4(2) no
C105 P11 C101 C103 . . . . 85.4(3) no
Pt1 P11 C101 C102 . . . . -9.3(3) no
Pt1 P11 C101 C103 . . . . -125.6(2) no
C101 P11 C105 C107 . . . . -51.7(3) no
Pt1 P13 C113 C114 . . . . -50.6(3) no
Pt1 P13 C113 C115 . . . . 67.0(3) no
Pt1 P13 C113 C116 . . . . -174.7(2) no
C109 P13 C113 C114 . . . . 80.1(3) no
C117 P13 C109 C110 . . . . -37.7(3) no
C117 P13 C109 C111 . . . . -160.7(3) no
C117 P13 C109 C112 . . . . 81.0(3) no
Pt1 P13 C109 C111 . . . . 76.2(3) no
Pt1 P13 C109 C112 . . . . -42.2(3) no
C113 P13 C109 C110 . . . . 69.1(3) no
C113 P13 C109 C111 . . . . -53.9(3) no
C113 P13 C109 C112 . . . . -172.3(3) no
C117 P13 C113 C116 . . . . 61.8(3) no
C109 P13 C113 C115 . . . . -162.4(3) no
Pt1 P13 C109 C110 . . . . -160.9(2) no
C117 P13 C113 C114 . . . . -174.1(3) no
C117 P13 C113 C115 . . . . -56.5(3) no
C109 P13 C113 C116 . . . . -44.0(3) no
C130 P14 C118 C119 . . . . 49.4(4) no
C124 P14 C118 C119 . . . . -53.6(3) no
C118 P14 C124 C129 . . . . 119.1(3) no
C124 P14 C118 C123 . . . . 122.1(3) no
C130 P14 C124 C129 . . . . 10.5(4) no
C130 P14 C118 C123 . . . . -134.8(3) no
Pt1 P14 C124 C125 . . . . 63.8(3) no
Pt1 P14 C124 C129 . . . . -116.0(3) no
C118 P14 C124 C125 . . . . -61.1(3) no
Pt1 P14 C118 C123 . . . . -6.9(3) yes
C124 P14 C130 C135 . . . . 106.7(3) no
Pt1 P14 C118 C119 . . . . 177.4(3) no
C130 P14 C124 C125 . . . . -169.7(3) no
Pt1 P14 C130 C131 . . . . 56.9(3) no
Pt1 P14 C130 C135 . . . . -123.3(3) no
C118 P14 C130 C131 . . . . -175.4(3) no
C118 P14 C130 C135 . . . . 4.4(4) no
C124 P14 C130 C131 . . . . -73.2(3) no
C201 P21 C205 C206 . . . . -169.9(2) no
C201 P21 C205 C207 . . . . -51.1(3) no
C201 P21 C205 C208 . . . . 72.8(3) no
Pt2 P21 C201 C203 . . . . -127.0(2) no
Pt2 P21 C201 C204 . . . . 110.5(3) no
P22 P21 C201 C202 . . . . 64.5(3) no
P22 P21 C201 C203 . . . . -51.8(3) no
P22 P21 C201 C204 . . . . -174.3(2) no
C201 P21 P22 Pt2 . . . . -115.53(13) no
C205 P21 P22 Pt2 . . . . 111.59(13) no
Pt2 P21 C201 C202 . . . . -10.7(3) no
C205 P21 C201 C204 . . . . -38.8(3) no
Pt2 P21 C205 C206 . . . . 40.0(3) no
Pt2 P21 C205 C207 . . . . 158.8(2) no
Pt2 P21 C205 C208 . . . . -77.3(3) no
P22 P21 C205 C206 . . . . -36.6(3) no
P22 P21 C205 C207 . . . . 82.2(3) no
C205 P21 C201 C203 . . . . 83.7(3) no
C205 P21 C201 C202 . . . . -160.0(3) no
P22 P21 C205 C208 . . . . -153.9(2) no
Pt2 P23 C209 C211 . . . . 78.6(3) no
Pt2 P23 C209 C212 . . . . -39.7(3) no
C213 P23 C209 C211 . . . . -51.9(3) no
C213 P23 C209 C212 . . . . -170.2(2) no
C213 P23 C209 C210 . . . . 71.5(3) no
Pt2 P23 C209 C210 . . . . -158.1(2) no
C209 P23 C213 C216 . . . . -43.6(3) no
C217 P23 C213 C214 . . . . -174.0(3) no
C217 P23 C213 C215 . . . . -56.7(3) no
C217 P23 C213 C216 . . . . 62.2(3) no
Pt2 P23 C213 C215 . . . . 67.2(3) no
Pt2 P23 C213 C216 . . . . -173.9(3) no
C209 P23 C213 C215 . . . . -162.4(2) no
C217 P23 C209 C210 . . . . -34.4(3) no
C217 P23 C209 C211 . . . . -157.8(3) no
C217 P23 C209 C212 . . . . 83.9(3) no
Pt2 P23 C213 C214 . . . . -50.1(3) no
C209 P23 C213 C214 . . . . 80.3(3) no
C224 P24 C230 C231 . . . . -73.9(3) no
C224 P24 C230 C235 . . . . 107.2(3) no
C230 P24 C224 C229 . . . . 10.8(3) no
Pt2 P24 C230 C231 . . . . 56.7(3) no
Pt2 P24 C230 C235 . . . . -122.2(3) no
C218 P24 C230 C231 . . . . -174.3(3) no
C218 P24 C230 C235 . . . . 6.8(4) no
Pt2 P24 C218 C219 . . . . -179.6(3) no
Pt2 P24 C218 C223 . . . . -3.0(3) yes
C218 P24 C224 C229 . . . . 117.9(3) no
C224 P24 C218 C223 . . . . 125.7(3) no
C230 P24 C218 C219 . . . . 53.2(3) no
C230 P24 C218 C223 . . . . -130.2(3) no
Pt2 P24 C224 C225 . . . . 64.8(3) no
Pt2 P24 C224 C229 . . . . -115.8(3) no
C218 P24 C224 C225 . . . . -61.5(3) no
C224 P24 C218 C219 . . . . -50.9(3) no
C230 P24 C224 C225 . . . . -168.7(3) no
P32 P31 C301 C304 . . . . 172.6(2) no
P32 P31 C305 C307 . . . . -81.6(3) no
C305 P31 C301 C303 . . . . -85.1(3) no
C305 P31 C301 C304 . . . . 37.1(3) no
Pt3 P31 C305 C306 . . . . -39.4(3) no
Pt3 P31 C305 C307 . . . . -157.8(2) no
Pt3 P31 C305 C308 . . . . 78.4(3) no
P32 P31 C305 C306 . . . . 36.8(3) no
C305 P31 C301 C302 . . . . 158.2(3) no
P32 P31 C305 C308 . . . . 154.6(2) no
C301 P31 C305 C306 . . . . 170.3(3) no
C301 P31 C305 C307 . . . . 51.9(3) no
C301 P31 C305 C308 . . . . -71.9(3) no
Pt3 P31 C301 C304 . . . . -112.1(3) no
P32 P31 C301 C302 . . . . -66.3(3) no
P32 P31 C301 C303 . . . . 50.4(3) no
Pt3 P31 C301 C302 . . . . 9.0(3) no
C301 P31 P32 Pt3 . . . . 115.91(13) no
C305 P31 P32 Pt3 . . . . -110.79(13) no
Pt3 P31 C301 C303 . . . . 125.7(2) no
C313 P33 C309 C310 . . . . -69.0(3) no
C317 P33 C309 C312 . . . . -80.9(3) no
Pt3 P33 C313 C314 . . . . 50.1(3) no
Pt3 P33 C309 C312 . . . . 42.2(3) no
C313 P33 C309 C311 . . . . 53.4(3) no
C313 P33 C309 C312 . . . . 172.4(2) no
C317 P33 C309 C310 . . . . 37.7(3) no
C317 P33 C309 C311 . . . . 160.1(3) no
Pt3 P33 C309 C310 . . . . 160.8(2) no
Pt3 P33 C309 C311 . . . . -76.8(3) no
C317 P33 C313 C314 . . . . 173.7(3) no
C317 P33 C313 C316 . . . . -62.9(3) no
Pt3 P33 C313 C315 . . . . -67.2(3) no
Pt3 P33 C313 C316 . . . . 173.6(3) no
C309 P33 C313 C314 . . . . -80.4(3) no
C309 P33 C313 C315 . . . . 162.3(2) no
C309 P33 C313 C316 . . . . 43.1(3) no
C317 P33 C313 C315 . . . . 56.4(3) no
C318 P34 C324 C329 . . . . -118.6(3) no
C324 P34 C318 C319 . . . . 54.0(3) no
C324 P34 C318 C323 . . . . -121.2(3) no
C330 P34 C318 C319 . . . . -49.2(3) no
C330 P34 C318 C323 . . . . 135.6(3) no
Pt3 P34 C324 C325 . . . . -63.6(3) no
Pt3 P34 C324 C329 . . . . 116.5(3) no
C318 P34 C324 C325 . . . . 61.4(3) no
Pt3 P34 C318 C323 . . . . 7.5(3) yes
C324 P34 C330 C335 . . . . -107.3(3) no
C330 P34 C324 C325 . . . . 169.7(3) no
C330 P34 C324 C329 . . . . -10.3(4) no
Pt3 P34 C330 C331 . . . . -56.5(3) no
Pt3 P34 C330 C335 . . . . 122.4(3) no
C318 P34 C330 C331 . . . . 175.4(3) no
C318 P34 C330 C335 . . . . -5.7(4) no
C324 P34 C330 C331 . . . . 73.8(3) no
Pt3 P34 C318 C319 . . . . -177.3(3) no
C401 P41 C405 C407 . . . . -72.7(3) no
C401 P41 C405 C408 . . . . 50.7(3) no
Pt4 P41 C401 C403 . . . . 127.0(2) no
Pt4 P41 C401 C404 . . . . -110.2(3) no
P42 P41 C401 C402 . . . . -64.4(3) no
P42 P41 C401 C404 . . . . 174.6(2) no
C401 P41 C405 C406 . . . . 170.1(2) no
C401 P41 P42 Pt4 . . . . 115.53(13) no
C405 P41 P42 Pt4 . . . . -111.41(13) no
Pt4 P41 C401 C402 . . . . 10.8(3) no
C405 P41 C401 C404 . . . . 39.0(3) no
Pt4 P41 C405 C406 . . . . -39.9(3) no
Pt4 P41 C405 C407 . . . . 77.4(3) no
P42 P41 C401 C403 . . . . 51.8(3) no
P42 P41 C405 C406 . . . . 36.6(3) no
C405 P41 C401 C402 . . . . 160.0(3) no
C405 P41 C401 C403 . . . . -83.8(3) no
Pt4 P41 C405 C408 . . . . -159.3(2) no
P42 P41 C405 C407 . . . . 153.9(2) no
P42 P41 C405 C408 . . . . -82.8(3) no
Pt4 P43 C409 C411 . . . . -78.7(3) no
C417 P43 C413 C416 . . . . -62.0(3) no
Pt4 P43 C409 C412 . . . . 39.8(3) no
Pt4 P43 C409 C410 . . . . 158.2(2) no
Pt4 P43 C413 C415 . . . . -66.7(3) no
Pt4 P43 C413 C416 . . . . 174.3(3) no
C409 P43 C413 C414 . . . . -80.2(3) no
C409 P43 C413 C415 . . . . 162.9(2) no
C409 P43 C413 C416 . . . . 43.9(3) no
C417 P43 C413 C414 . . . . 174.0(3) no
C417 P43 C413 C415 . . . . 57.0(3) no
Pt4 P43 C413 C414 . . . . 50.3(3) no
C413 P43 C409 C410 . . . . -71.3(3) no
C413 P43 C409 C411 . . . . 51.9(3) no
C413 P43 C409 C412 . . . . 170.4(2) no
C417 P43 C409 C410 . . . . 35.1(3) no
C417 P43 C409 C411 . . . . 158.3(3) no
C417 P43 C409 C412 . . . . -83.2(3) no
C418 P44 C430 C435 . . . . -7.3(4) no
C418 P44 C424 C425 . . . . 61.0(3) no
C418 P44 C424 C429 . . . . -118.5(3) no
C430 P44 C424 C425 . . . . 168.0(3) no
C430 P44 C424 C429 . . . . -11.5(4) no
Pt4 P44 C430 C431 . . . . -56.2(3) no
Pt4 P44 C430 C435 . . . . 121.8(3) no
C418 P44 C430 C431 . . . . 174.7(3) no
Pt4 P44 C424 C425 . . . . -65.6(3) no
Pt4 P44 C418 C419 . . . . 179.5(2) no
Pt4 P44 C418 C423 . . . . 3.3(3) yes
C424 P44 C418 C419 . . . . 50.3(3) no
C424 P44 C418 C423 . . . . -125.8(3) no
C430 P44 C418 C419 . . . . -52.9(3) no
C430 P44 C418 C423 . . . . 130.9(3) no
C424 P44 C430 C431 . . . . 74.3(3) no
Pt4 P44 C424 C429 . . . . 115.0(3) no
C424 P44 C430 C435 . . . . -107.7(3) no
P14 C118 C123 C122 . . . . -178.3(3) no
C119 C118 C123 C122 . . . . -2.4(6) no
C123 C118 C119 C120 . . . . 3.6(5) no
P14 C118 C119 C120 . . . . 179.3(3) no
C118 C119 C120 C121 . . . . -1.9(6) no
C119 C120 C121 C122 . . . . -1.2(6) no
C120 C121 C122 C123 . . . . 2.4(6) no
C121 C122 C123 C118 . . . . -0.6(6) no
C125 C124 C129 C128 . . . . -2.4(6) no
C129 C124 C125 C126 . . . . 2.3(6) no
P14 C124 C129 C128 . . . . 177.4(3) no
P14 C124 C125 C126 . . . . -177.6(3) no
C124 C125 C126 C127 . . . . -0.1(6) no
C125 C126 C127 C128 . . . . -1.9(6) no
C126 C127 C128 C129 . . . . 1.7(6) no
C127 C128 C129 C124 . . . . 0.5(6) no
C135 C130 C131 C132 . . . . -1.4(5) no
C131 C130 C135 C134 . . . . 0.5(5) no
P14 C130 C131 C132 . . . . 178.5(3) no
P14 C130 C135 C134 . . . . -179.3(3) no
C130 C131 C132 C133 . . . . 1.2(6) no
C131 C132 C133 C134 . . . . -0.1(6) no
C132 C133 C134 C135 . . . . -0.7(6) no
C133 C134 C135 C130 . . . . 0.5(6) no
P24 C218 C219 C220 . . . . 178.1(3) no
C223 C218 C219 C220 . . . . 1.5(5) no
P24 C218 C223 C222 . . . . -178.5(3) no
C219 C218 C223 C222 . . . . -1.8(5) no
C218 C219 C220 C221 . . . . -0.3(6) no
C219 C220 C221 C222 . . . . -0.6(6) no
C220 C221 C222 C223 . . . . 0.4(6) no
C221 C222 C223 C218 . . . . 0.8(6) no
C229 C224 C225 C226 . . . . 1.7(6) no
P24 C224 C229 C228 . . . . 178.2(3) no
C225 C224 C229 C228 . . . . -2.4(5) no
P24 C224 C225 C226 . . . . -178.8(3) no
C224 C225 C226 C227 . . . . 1.2(6) no
C225 C226 C227 C228 . . . . -3.4(6) no
C226 C227 C228 C229 . . . . 2.7(6) no
C227 C228 C229 C224 . . . . 0.2(6) no
C231 C230 C235 C234 . . . . 0.2(5) no
C235 C230 C231 C232 . . . . -1.0(5) no
P24 C230 C235 C234 . . . . 179.1(3) no
P24 C230 C231 C232 . . . . 180.0(3) no
C230 C231 C232 C233 . . . . 1.2(6) no
C231 C232 C233 C234 . . . . -0.5(6) no
C232 C233 C234 C235 . . . . -0.3(6) no
C233 C234 C235 C230 . . . . 0.4(6) no
P34 C318 C319 C320 . . . . -178.7(3) no
P34 C318 C323 C322 . . . . 178.0(3) no
C319 C318 C323 C322 . . . . 2.6(5) no
C323 C318 C319 C320 . . . . -3.4(5) no
C318 C319 C320 C321 . . . . 1.7(6) no
C319 C320 C321 C322 . . . . 1.0(6) no
C320 C321 C322 C323 . . . . -1.9(6) no
C321 C322 C323 C318 . . . . 0.1(6) no
P34 C324 C329 C328 . . . . -177.3(3) no
C325 C324 C329 C328 . . . . 2.7(6) no
C329 C324 C325 C326 . . . . -2.5(6) no
P34 C324 C325 C326 . . . . 177.5(3) no
C324 C325 C326 C327 . . . . 0.0(6) no
C325 C326 C327 C328 . . . . 2.5(6) no
C326 C327 C328 C329 . . . . -2.3(6) no
C327 C328 C329 C324 . . . . -0.3(6) no
P34 C330 C331 C332 . . . . -179.1(3) no
C331 C330 C335 C334 . . . . -1.3(5) no
C335 C330 C331 C332 . . . . 2.0(6) no
P34 C330 C335 C334 . . . . 179.8(3) no
C330 C331 C332 C333 . . . . -1.8(6) no
C331 C332 C333 C334 . . . . 1.0(6) no
C332 C333 C334 C335 . . . . -0.4(6) no
C333 C334 C335 C330 . . . . 0.6(6) no
P44 C418 C419 C420 . . . . -178.2(3) no
C423 C418 C419 C420 . . . . -2.1(5) no
P44 C418 C423 C422 . . . . 178.4(3) no
C419 C418 C423 C422 . . . . 2.1(5) no
C418 C419 C420 C421 . . . . 0.8(5) no
C419 C420 C421 C422 . . . . 0.4(6) no
C420 C421 C422 C423 . . . . -0.4(6) no
C421 C422 C423 C418 . . . . -0.9(6) no
P44 C424 C425 C426 . . . . 178.3(3) no
C429 C424 C425 C426 . . . . -2.2(6) no
P44 C424 C429 C428 . . . . -177.4(3) no
C425 C424 C429 C428 . . . . 3.1(6) no
C424 C425 C426 C427 . . . . -0.7(6) no
C425 C426 C427 C428 . . . . 2.7(6) no
C426 C427 C428 C429 . . . . -1.8(7) no
C427 C428 C429 C424 . . . . -1.1(6) no
P44 C430 C431 C432 . . . . -179.5(3) no
C435 C430 C431 C432 . . . . 2.4(6) no
P44 C430 C435 C434 . . . . -179.2(3) no
C431 C430 C435 C434 . . . . -1.2(5) no
C430 C431 C432 C433 . . . . -2.3(6) no
C431 C432 C433 C434 . . . . 0.9(6) no
C432 C433 C434 C435 . . . . 0.2(6) no
C433 C434 C435 C430 . . . . -0.1(6) no
