#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/48/4314804.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4314804
loop_
_publ_author_name
'Moran Feller'
'Eyal Ben-Ari'
'Mark A. Iron'
'Yael Diskin-Posner'
'Gregory Leitus'
'Linda J. W. Shimon'
'Leonid Konstantinovski'
'David Milstein'
_publ_section_title
;
 Cationic, Neutral, and Anionic PNP PdII and PtII Complexes:
 Dearomatization by Deprotonation and Double-Deprotonation of Pincer
 Systems
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1615
_journal_page_last               1625
_journal_paper_doi               10.1021/ic902012z
_journal_volume                  49
_journal_year                    2010
_chemical_formula_moiety         'C24 H46 N P2 Pt, C H Cl3, Cl'
_chemical_formula_sum            'C25 H47 Cl4 N P2 Pt'
_chemical_formula_weight         760.47
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                114.7330(10)
_cell_angle_beta                 99.124(2)
_cell_angle_gamma                96.400(2)
_cell_formula_units_Z            4
_cell_length_a                   14.5689(8)
_cell_length_b                   15.4434(4)
_cell_length_c                   16.2371(5)
_cell_measurement_reflns_used    89865
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      33.542
_cell_measurement_theta_min      2.4645
_cell_volume                     3211.1(2)
_computing_cell_refinement       'APEX II'
_computing_data_collection       'APEX II'
_computing_data_reduction        'APEX II'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.978
_diffrn_measured_fraction_theta_max 0.978
_diffrn_measurement_device_type  'Bruker KappaAPEXII CCD detector'
_diffrn_measurement_method       'Phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0301
_diffrn_reflns_av_sigmaI/netI    0.0276
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            89810
_diffrn_reflns_theta_full        33.54
_diffrn_reflns_theta_max         33.54
_diffrn_reflns_theta_min         2.08
_exptl_absorpt_coefficient_mu    4.817
_exptl_absorpt_correction_T_max  0.5956
_exptl_absorpt_correction_T_min  0.1968
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   'SHELXL-97 (Sheldrick, 1997)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.573
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1520
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.12
_refine_diff_density_max         2.558
_refine_diff_density_min         -1.863
_refine_diff_density_rms         0.103
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.849
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     622
_refine_ls_number_reflns         24725
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.849
_refine_ls_R_factor_all          0.0257
_refine_ls_R_factor_gt           0.0205
_refine_ls_shift/su_max          0.017
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0237P)²+6.3113P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0485
_refine_ls_wR_factor_ref         0.0512
_reflns_number_gt                21984
_reflns_number_total             24725
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic902012z_si_001_4.cif
_cod_data_source_block           complex4
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to the built-in table from CIF Core dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_original_sg_symbol_Hall     -P1
_cod_database_code               4314804
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.417830(4) 0.947038(4) 0.679436(4) 0.01042(2) Uani 1 1 d . . .
C1 C 0.44251(15) 0.94896(15) 0.55887(13) 0.0207(4) Uani 1 1 d . . .
H1A H 0.3819 0.9330 0.5145 0.031 Uiso 1 1 calc R . .
H1B H 0.4812 0.9009 0.5316 0.031 Uiso 1 1 calc R . .
H1C H 0.4762 1.0139 0.5730 0.031 Uiso 1 1 calc R . .
N11 N 0.38625(10) 0.94266(10) 0.80006(9) 0.0103(2) Uani 1 1 d . . .
C12 C 0.39622(11) 0.86406(12) 0.81613(11) 0.0111(3) Uani 1 1 d . . .
C13 C 0.38838(12) 0.86487(13) 0.90038(12) 0.0138(3) Uani 1 1 d . . .
H13 H 0.3961 0.8098 0.9110 0.017 Uiso 1 1 calc R . .
C14 C 0.36916(13) 0.94702(13) 0.96902(12) 0.0150(3) Uani 1 1 d . . .
H14 H 0.3647 0.9491 1.0275 0.018 Uiso 1 1 calc R . .
C15 C 0.35652(12) 1.02586(12) 0.95178(11) 0.0132(3) Uani 1 1 d . . .
H15 H 0.3428 1.0823 0.9981 0.016 Uiso 1 1 calc R . .
C16 C 0.36409(11) 1.02165(12) 0.86598(11) 0.0106(3) Uani 1 1 d . . .
P2 P 0.46004(3) 0.80087(3) 0.65192(3) 0.01106(7) Uani 1 1 d . . .
C21 C 0.41193(12) 0.77464(12) 0.73875(12) 0.0129(3) Uani 1 1 d . . .
H21A H 0.3509 0.7275 0.7076 0.015 Uiso 1 1 calc R . .
H21B H 0.4564 0.7440 0.7653 0.015 Uiso 1 1 calc R . .
C22 C 0.59133(12) 0.81533(13) 0.68991(12) 0.0141(3) Uani 1 1 d . . .
C23 C 0.40812(13) 0.68973(13) 0.53884(12) 0.0169(3) Uani 1 1 d . . .
C24 C 0.61847(13) 0.88761(14) 0.79393(13) 0.0183(3) Uani 1 1 d . . .
H24A H 0.6876 0.9030 0.8158 0.027 Uiso 1 1 calc R . .
H24B H 0.5898 0.8585 0.8294 0.027 Uiso 1 1 calc R . .
H24C H 0.5953 0.9474 0.8028 0.027 Uiso 1 1 calc R . .
C25 C 0.64194(13) 0.86140(15) 0.63776(14) 0.0201(3) Uani 1 1 d . . .
H25A H 0.7105 0.8775 0.6639 0.030 Uiso 1 1 calc R . .
H25B H 0.6191 0.9208 0.6445 0.030 Uiso 1 1 calc R . .
H25C H 0.6286 0.8154 0.5716 0.030 Uiso 1 1 calc R . .
C26 C 0.62253(13) 0.72040(14) 0.67968(14) 0.0192(3) Uani 1 1 d . . .
H26A H 0.6080 0.6739 0.6136 0.029 Uiso 1 1 calc R . .
H26B H 0.5885 0.6929 0.7135 0.029 Uiso 1 1 calc R . .
H26C H 0.6909 0.7337 0.7054 0.029 Uiso 1 1 calc R . .
C27 C 0.30793(14) 0.70185(16) 0.50433(14) 0.0237(4) Uani 1 1 d . . .
H27A H 0.2768 0.6448 0.4457 0.036 Uiso 1 1 calc R . .
H27B H 0.3125 0.7603 0.4942 0.036 Uiso 1 1 calc R . .
H27C H 0.2707 0.7082 0.5511 0.036 Uiso 1 1 calc R . .
C28 C 0.40000(16) 0.59433(14) 0.54863(15) 0.0245(4) Uani 1 1 d . . .
H28A H 0.3735 0.5391 0.4874 0.037 Uiso 1 1 calc R . .
H28B H 0.3583 0.5955 0.5907 0.037 Uiso 1 1 calc R . .
H28C H 0.4630 0.5877 0.5740 0.037 Uiso 1 1 calc R . .
C29 C 0.46653(16) 0.68359(16) 0.46627(13) 0.0251(4) Uani 1 1 d . . .
H29A H 0.5293 0.6721 0.4858 0.038 Uiso 1 1 calc R . .
H29B H 0.4736 0.7448 0.4610 0.038 Uiso 1 1 calc R . .
H29C H 0.4339 0.6300 0.4058 0.038 Uiso 1 1 calc R . .
P3 P 0.39576(3) 1.10473(3) 0.74801(3) 0.01158(7) Uani 1 1 d . . .
C31 C 0.34288(12) 1.10287(12) 0.84264(12) 0.0128(3) Uani 1 1 d . . .
H31A H 0.3674 1.1657 0.8988 0.015 Uiso 1 1 calc R . .
H31B H 0.2733 1.0957 0.8243 0.015 Uiso 1 1 calc R . .
C32 C 0.51182(13) 1.19364(13) 0.80800(13) 0.0165(3) Uani 1 1 d . . .
C33 C 0.30888(13) 1.14858(13) 0.68435(12) 0.0148(3) Uani 1 1 d . . .
C34 C 0.57514(14) 1.18243(17) 0.73850(16) 0.0248(4) Uani 1 1 d . . .
H34A H 0.6355 1.2289 0.7705 0.037 Uiso 1 1 calc R . .
H34B H 0.5432 1.1952 0.6881 0.037 Uiso 1 1 calc R . .
H34C H 0.5871 1.1161 0.7126 0.037 Uiso 1 1 calc R . .
C35 C 0.50081(15) 1.29972(14) 0.85702(15) 0.0233(4) Uani 1 1 d . . .
H35A H 0.4586 1.3055 0.8997 0.035 Uiso 1 1 calc R . .
H35B H 0.4737 1.3202 0.8105 0.035 Uiso 1 1 calc R . .
H35C H 0.5631 1.3413 0.8922 0.035 Uiso 1 1 calc R . .
C36 C 0.56073(14) 1.16613(15) 0.88221(14) 0.0209(4) Uani 1 1 d . . .
H36A H 0.5643 1.0971 0.8530 0.031 Uiso 1 1 calc R . .
H36B H 0.5242 1.1781 0.9303 0.031 Uiso 1 1 calc R . .
H36C H 0.6249 1.2057 0.9106 0.031 Uiso 1 1 calc R . .
C37 C 0.26923(14) 1.23296(14) 0.74978(14) 0.0181(3) Uani 1 1 d . . .
H37A H 0.2230 1.2518 0.7128 0.027 Uiso 1 1 calc R . .
H37B H 0.3212 1.2886 0.7886 0.027 Uiso 1 1 calc R . .
H37C H 0.2382 1.2123 0.7897 0.027 Uiso 1 1 calc R . .
C38 C 0.35389(15) 1.17904(16) 0.61858(14) 0.0217(4) Uani 1 1 d . . .
H38A H 0.3055 1.1950 0.5809 0.032 Uiso 1 1 calc R . .
H38B H 0.3798 1.1254 0.5776 0.032 Uiso 1 1 calc R . .
H38C H 0.4050 1.2361 0.6553 0.032 Uiso 1 1 calc R . .
C39 C 0.22632(13) 1.06162(14) 0.62606(13) 0.0196(3) Uani 1 1 d . . .
H39A H 0.1973 1.0417 0.6675 0.029 Uiso 1 1 calc R . .
H39B H 0.2502 1.0073 0.5833 0.029 Uiso 1 1 calc R . .
H39C H 0.1788 1.0804 0.5902 0.029 Uiso 1 1 calc R . .
Pt2 Pt 0.101688(4) 0.326756(4) 0.252237(4) 0.00983(2) Uani 1 1 d . . .
C2 C 0.08825(14) 0.46571(13) 0.33802(14) 0.0194(3) Uani 1 1 d . . .
H2A H 0.1513 0.5058 0.3727 0.029 Uiso 1 1 calc R . .
H2B H 0.0502 0.4631 0.3819 0.029 Uiso 1 1 calc R . .
H2C H 0.0569 0.4942 0.3002 0.029 Uiso 1 1 calc R . .
N41 N 0.12087(10) 0.18605(10) 0.16733(10) 0.0101(2) Uani 1 1 d . . .
C42 C 0.14611(11) 0.16707(11) 0.08506(11) 0.0106(3) Uani 1 1 d . . .
C43 C 0.14612(12) 0.07249(12) 0.02179(12) 0.0128(3) Uani 1 1 d . . .
H43 H 0.1617 0.0599 -0.0363 0.015 Uiso 1 1 calc R . .
C44 C 0.12323(13) -0.00326(12) 0.04415(12) 0.0147(3) Uani 1 1 d . . .
H44 H 0.1226 -0.0683 0.0014 0.018 Uiso 1 1 calc R . .
C45 C 0.10127(12) 0.01655(12) 0.12956(12) 0.0136(3) Uani 1 1 d . . .
H45 H 0.0868 -0.0345 0.1464 0.016 Uiso 1 1 calc R . .
C46 C 0.10071(11) 0.11191(12) 0.19009(11) 0.0108(3) Uani 1 1 d . . .
P5 P 0.13487(3) 0.35972(3) 0.13308(3) 0.01154(7) Uani 1 1 d . . .
C51 C 0.17905(12) 0.25065(12) 0.06591(12) 0.0125(3) Uani 1 1 d . . .
H51A H 0.1571 0.2315 -0.0013 0.015 Uiso 1 1 calc R . .
H51B H 0.2493 0.2660 0.0814 0.015 Uiso 1 1 calc R . .
C52 C 0.23190(13) 0.46258(12) 0.15579(13) 0.0157(3) Uani 1 1 d . . .
C53 C 0.02311(13) 0.35377(13) 0.05348(13) 0.0160(3) Uani 1 1 d . . .
C54 C 0.27504(14) 0.44627(15) 0.07104(14) 0.0207(3) Uani 1 1 d . . .
H54A H 0.2262 0.4420 0.0197 0.031 Uiso 1 1 calc R . .
H54B H 0.2991 0.3856 0.0515 0.031 Uiso 1 1 calc R . .
H54C H 0.3272 0.5008 0.0879 0.031 Uiso 1 1 calc R . .
C55 C 0.19765(16) 0.55918(14) 0.18910(17) 0.0257(4) Uani 1 1 d . . .
H55A H 0.2517 0.6127 0.2088 0.038 Uiso 1 1 calc R . .
H55B H 0.1683 0.5681 0.2417 0.038 Uiso 1 1 calc R . .
H55C H 0.1510 0.5585 0.1381 0.038 Uiso 1 1 calc R . .
C56 C 0.31015(13) 0.46711(14) 0.23405(13) 0.0195(3) Uani 1 1 d . . .
H56A H 0.3634 0.5200 0.2492 0.029 Uiso 1 1 calc R . .
H56B H 0.3320 0.4052 0.2134 0.029 Uiso 1 1 calc R . .
H56C H 0.2848 0.4790 0.2894 0.029 Uiso 1 1 calc R . .
C57 C -0.03406(14) 0.42597(15) 0.10912(15) 0.0226(4) Uani 1 1 d . . .
H57A H 0.0031 0.4923 0.1359 0.034 Uiso 1 1 calc R . .
H57B H -0.0484 0.4110 0.1593 0.034 Uiso 1 1 calc R . .
H57C H -0.0934 0.4207 0.0677 0.034 Uiso 1 1 calc R . .
C58 C 0.04061(15) 0.37098(15) -0.02969(14) 0.0223(4) Uani 1 1 d . . .
H58A H 0.0790 0.3258 -0.0632 0.033 Uiso 1 1 calc R . .
H58B H 0.0743 0.4380 -0.0073 0.033 Uiso 1 1 calc R . .
H58C H -0.0203 0.3602 -0.0717 0.033 Uiso 1 1 calc R . .
C59 C -0.03527(14) 0.25030(14) 0.01556(14) 0.0195(3) Uani 1 1 d . . .
H59A H -0.0983 0.2460 -0.0195 0.029 Uiso 1 1 calc R . .
H59B H -0.0418 0.2353 0.0676 0.029 Uiso 1 1 calc R . .
H59C H -0.0029 0.2036 -0.0255 0.029 Uiso 1 1 calc R . .
P6 P 0.04874(3) 0.25481(3) 0.33892(3) 0.01037(7) Uani 1 1 d . . .
C61 C 0.08203(12) 0.13547(12) 0.28463(12) 0.0126(3) Uani 1 1 d . . .
H61A H 0.1397 0.1346 0.3256 0.015 Uiso 1 1 calc R . .
H61B H 0.0304 0.0845 0.2790 0.015 Uiso 1 1 calc R . .
C62 C -0.08397(12) 0.22530(13) 0.31417(12) 0.0138(3) Uani 1 1 d . . .
C63 C 0.10537(13) 0.30240(13) 0.46583(12) 0.0150(3) Uani 1 1 d . . .
C64 C -0.12260(13) 0.31940(15) 0.33774(15) 0.0207(4) Uani 1 1 d . . .
H64A H -0.1920 0.3034 0.3178 0.031 Uiso 1 1 calc R . .
H64B H -0.0966 0.3541 0.3054 0.031 Uiso 1 1 calc R . .
H64C H -0.1039 0.3607 0.4051 0.031 Uiso 1 1 calc R . .
C65 C -0.12218(13) 0.17006(14) 0.36503(14) 0.0191(3) Uani 1 1 d . . .
H65A H -0.1064 0.2127 0.4322 0.029 Uiso 1 1 calc R . .
H65B H -0.0934 0.1127 0.3526 0.029 Uiso 1 1 calc R . .
H65C H -0.1912 0.1494 0.3429 0.029 Uiso 1 1 calc R . .
C66 C -0.11761(13) 0.16047(15) 0.20867(13) 0.0197(3) Uani 1 1 d . . .
H66A H -0.1870 0.1484 0.1909 0.030 Uiso 1 1 calc R . .
H66B H -0.0966 0.0985 0.1927 0.030 Uiso 1 1 calc R . .
H66C H -0.0906 0.1933 0.1752 0.030 Uiso 1 1 calc R . .
C67 C 0.10062(15) 0.22313(16) 0.49976(14) 0.0218(4) Uani 1 1 d . . .
H67A H 0.1356 0.1740 0.4662 0.033 Uiso 1 1 calc R . .
H67B H 0.0342 0.1924 0.4880 0.033 Uiso 1 1 calc R . .
H67C H 0.1290 0.2525 0.5667 0.033 Uiso 1 1 calc R . .
C68 C 0.06040(15) 0.38471(15) 0.52650(13) 0.0223(4) Uani 1 1 d . . .
H68A H 0.0961 0.4133 0.5913 0.033 Uiso 1 1 calc R . .
H68B H -0.0055 0.3585 0.5225 0.033 Uiso 1 1 calc R . .
H68C H 0.0619 0.4349 0.5044 0.033 Uiso 1 1 calc R . .
C69 C 0.20982(13) 0.34393(16) 0.47740(14) 0.0226(4) Uani 1 1 d . . .
H69A H 0.2139 0.3968 0.4590 0.034 Uiso 1 1 calc R . .
H69B H 0.2392 0.2925 0.4380 0.034 Uiso 1 1 calc R . .
H69C H 0.2432 0.3690 0.5427 0.034 Uiso 1 1 calc R . .
Cl1 Cl 0.43543(3) 0.27675(3) 0.09175(3) 0.01737(7) Uani 1 1 d . . .
Cl2 Cl 0.91074(3) 0.90641(3) 0.18473(3) 0.01746(7) Uani 1 1 d . . .
C70 C 0.05802(19) 0.8293(2) 0.30243(18) 0.0336(5) Uani 1 1 d . . .
H70 H 0.0081 0.8378 0.2580 0.040 Uiso 1 1 calc R . .
Cl3 Cl 0.16466(7) 0.83366(10) 0.26569(9) 0.0785(3) Uani 1 1 d . . .
Cl4 Cl 0.02347(7) 0.71374(6) 0.29796(6) 0.0541(2) Uani 1 1 d . . .
Cl5 Cl 0.06518(8) 0.92077(6) 0.41525(5) 0.0635(3) Uani 1 1 d . . .
C71 C 0.37403(16) 0.54779(16) 0.81986(17) 0.0266(4) Uani 1 1 d . . .
H71 H 0.4280 0.6050 0.8501 0.032 Uiso 1 1 calc R . .
Cl6 Cl 0.40269(5) 0.45728(5) 0.72184(4) 0.03630(13) Uani 1 1 d . . .
Cl7 Cl 0.35668(7) 0.50402(5) 0.90089(5) 0.04822(19) Uani 1 1 d . . .
Cl8 Cl 0.27200(5) 0.58516(6) 0.78249(7) 0.04947(18) Uani 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 '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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 Pt1 N11 177.51(7) . . ?
C1 Pt1 P2 96.23(6) . . ?
N11 Pt1 P2 84.07(4) . . ?
C1 Pt1 P3 96.09(6) . . ?
N11 Pt1 P3 84.04(4) . . ?
P2 Pt1 P3 164.366(16) . . ?
Pt1 C1 H1A 109.5 . . ?
Pt1 C1 H1B 109.5 . . ?
H1A C1 H1B 109.5 . . ?
Pt1 C1 H1C 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
C16 N11 C12 119.58(14) . . ?
C16 N11 Pt1 120.02(11) . . ?
C12 N11 Pt1 120.14(11) . . ?
N11 C12 C13 121.15(15) . . ?
N11 C12 C21 118.27(14) . . ?
C13 C12 C21 120.53(15) . . ?
C12 C13 C14 119.20(16) . . ?
C12 C13 H13 120.4 . . ?
C14 C13 H13 120.4 . . ?
C15 C14 C13 119.64(16) . . ?
C15 C14 H14 120.2 . . ?
C13 C14 H14 120.2 . . ?
C14 C15 C16 119.30(15) . . ?
C14 C15 H15 120.4 . . ?
C16 C15 H15 120.4 . . ?
N11 C16 C15 121.05(15) . . ?
N11 C16 C31 118.58(14) . . ?
C15 C16 C31 120.30(14) . . ?
C21 P2 C22 104.22(8) . . ?
C21 P2 C23 104.54(8) . . ?
C22 P2 C23 112.29(8) . . ?
C21 P2 Pt1 100.62(5) . . ?
C22 P2 Pt1 111.41(6) . . ?
C23 P2 Pt1 121.27(6) . . ?
C12 C21 P2 112.63(12) . . ?
C12 C21 H21A 109.1 . . ?
P2 C21 H21A 109.1 . . ?
C12 C21 H21B 109.1 . . ?
P2 C21 H21B 109.1 . . ?
H21A C21 H21B 107.8 . . ?
C26 C22 C25 111.77(15) . . ?
C26 C22 C24 107.95(15) . . ?
C25 C22 C24 107.75(15) . . ?
C26 C22 P2 113.40(12) . . ?
C25 C22 P2 109.48(12) . . ?
C24 C22 P2 106.18(11) . . ?
C28 C23 C29 109.06(16) . . ?
C28 C23 C27 108.73(16) . . ?
C29 C23 C27 108.73(17) . . ?
C28 C23 P2 113.36(13) . . ?
C29 C23 P2 110.80(13) . . ?
C27 C23 P2 106.02(12) . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C22 C25 H25A 109.5 . . ?
C22 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
C22 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C22 C26 H26A 109.5 . . ?
C22 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C22 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C23 C27 H27A 109.5 . . ?
C23 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C23 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
C23 C28 H28A 109.5 . . ?
C23 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
C23 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
C23 C29 H29A 109.5 . . ?
C23 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
C23 C29 H29C 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
C31 P3 C33 104.26(8) . . ?
C31 P3 C32 104.90(8) . . ?
C33 P3 C32 112.79(8) . . ?
C31 P3 Pt1 100.36(5) . . ?
C33 P3 Pt1 120.50(6) . . ?
C32 P3 Pt1 111.63(6) . . ?
C16 C31 P3 112.51(11) . . ?
C16 C31 H31A 109.1 . . ?
P3 C31 H31A 109.1 . . ?
C16 C31 H31B 109.1 . . ?
P3 C31 H31B 109.1 . . ?
H31A C31 H31B 107.8 . . ?
C35 C32 C36 108.11(16) . . ?
C35 C32 C34 110.27(16) . . ?
C36 C32 C34 108.10(16) . . ?
C35 C32 P3 113.64(13) . . ?
C36 C32 P3 106.36(12) . . ?
C34 C32 P3 110.13(13) . . ?
C39 C33 C38 108.95(16) . . ?
C39 C33 C37 108.34(15) . . ?
C38 C33 C37 109.79(15) . . ?
C39 C33 P3 106.03(12) . . ?
C38 C33 P3 110.54(13) . . ?
C37 C33 P3 113.03(12) . . ?
C32 C34 H34A 109.5 . . ?
C32 C34 H34B 109.5 . . ?
H34A C34 H34B 109.5 . . ?
C32 C34 H34C 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C32 C35 H35A 109.5 . . ?
C32 C35 H35B 109.5 . . ?
H35A C35 H35B 109.5 . . ?
C32 C35 H35C 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C32 C36 H36A 109.5 . . ?
C32 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C32 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
C33 C37 H37A 109.5 . . ?
C33 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
C33 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
C33 C38 H38A 109.5 . . ?
C33 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
C33 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
C33 C39 H39A 109.5 . . ?
C33 C39 H39B 109.5 . . ?
H39A C39 H39B 109.5 . . ?
C33 C39 H39C 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
C2 Pt2 N41 177.81(7) . . ?
C2 Pt2 P6 96.24(6) . . ?
N41 Pt2 P6 83.91(4) . . ?
C2 Pt2 P5 96.38(6) . . ?
N41 Pt2 P5 83.81(4) . . ?
P6 Pt2 P5 164.780(15) . . ?
Pt2 C2 H2A 109.5 . . ?
Pt2 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
Pt2 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C46 N41 C42 119.32(14) . . ?
C46 N41 Pt2 120.51(11) . . ?
C42 N41 Pt2 119.95(11) . . ?
N41 C42 C43 121.06(15) . . ?
N41 C42 C51 118.70(14) . . ?
C43 C42 C51 120.15(14) . . ?
C44 C43 C42 119.43(15) . . ?
C44 C43 H43 120.3 . . ?
C42 C43 H43 120.3 . . ?
C43 C44 C45 119.48(15) . . ?
C43 C44 H44 120.3 . . ?
C45 C44 H44 120.3 . . ?
C44 C45 C46 119.19(16) . . ?
C44 C45 H45 120.4 . . ?
C46 C45 H45 120.4 . . ?
N41 C46 C45 121.41(15) . . ?
N41 C46 C61 118.55(14) . . ?
C45 C46 C61 119.97(15) . . ?
C51 P5 C52 103.90(8) . . ?
C51 P5 C53 104.87(8) . . ?
C52 P5 C53 112.82(8) . . ?
C51 P5 Pt2 100.47(5) . . ?
C52 P5 Pt2 121.10(6) . . ?
C53 P5 Pt2 111.20(6) . . ?
C42 C51 P5 112.35(11) . . ?
C42 C51 H51A 109.1 . . ?
P5 C51 H51A 109.1 . . ?
C42 C51 H51B 109.1 . . ?
P5 C51 H51B 109.1 . . ?
H51A C51 H51B 107.9 . . ?
C55 C52 C56 109.06(16) . . ?
C55 C52 C54 109.81(16) . . ?
C56 C52 C54 107.85(15) . . ?
C55 C52 P5 111.19(13) . . ?
C56 C52 P5 105.54(12) . . ?
C54 C52 P5 113.18(13) . . ?
C58 C53 C57 110.59(16) . . ?
C58 C53 C59 108.06(16) . . ?
C57 C53 C59 108.29(16) . . ?
C58 C53 P5 113.56(13) . . ?
C57 C53 P5 109.87(13) . . ?
C59 C53 P5 106.24(12) . . ?
C52 C54 H54A 109.5 . . ?
C52 C54 H54B 109.5 . . ?
H54A C54 H54B 109.5 . . ?
C52 C54 H54C 109.5 . . ?
H54A C54 H54C 109.5 . . ?
H54B C54 H54C 109.5 . . ?
C52 C55 H55A 109.5 . . ?
C52 C55 H55B 109.5 . . ?
H55A C55 H55B 109.5 . . ?
C52 C55 H55C 109.5 . . ?
H55A C55 H55C 109.5 . . ?
H55B C55 H55C 109.5 . . ?
C52 C56 H56A 109.5 . . ?
C52 C56 H56B 109.5 . . ?
H56A C56 H56B 109.5 . . ?
C52 C56 H56C 109.5 . . ?
H56A C56 H56C 109.5 . . ?
H56B C56 H56C 109.5 . . ?
C53 C57 H57A 109.5 . . ?
C53 C57 H57B 109.5 . . ?
H57A C57 H57B 109.5 . . ?
C53 C57 H57C 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
C53 C58 H58A 109.5 . . ?
C53 C58 H58B 109.5 . . ?
H58A C58 H58B 109.5 . . ?
C53 C58 H58C 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
C53 C59 H59A 109.5 . . ?
C53 C59 H59B 109.5 . . ?
H59A C59 H59B 109.5 . . ?
C53 C59 H59C 109.5 . . ?
H59A C59 H59C 109.5 . . ?
H59B C59 H59C 109.5 . . ?
C61 P6 C62 103.99(8) . . ?
C61 P6 C63 103.81(8) . . ?
C62 P6 C63 112.68(8) . . ?
C61 P6 Pt2 100.83(5) . . ?
C62 P6 Pt2 112.08(6) . . ?
C63 P6 Pt2 120.77(6) . . ?
C46 C61 P6 112.81(12) . . ?
C46 C61 H61A 109.0 . . ?
P6 C61 H61A 109.0 . . ?
C46 C61 H61B 109.0 . . ?
P6 C61 H61B 109.0 . . ?
H61A C61 H61B 107.8 . . ?
C65 C62 C64 110.69(15) . . ?
C65 C62 C66 108.52(15) . . ?
C64 C62 C66 108.23(15) . . ?
C65 C62 P6 113.66(12) . . ?
C64 C62 P6 109.39(12) . . ?
C66 C62 P6 106.11(11) . . ?
C67 C63 C68 108.99(15) . . ?
C67 C63 C69 108.71(16) . . ?
C68 C63 C69 108.51(16) . . ?
C67 C63 P6 113.11(13) . . ?
C68 C63 P6 111.29(13) . . ?
C69 C63 P6 106.08(12) . . ?
C62 C64 H64A 109.5 . . ?
C62 C64 H64B 109.5 . . ?
H64A C64 H64B 109.5 . . ?
C62 C64 H64C 109.5 . . ?
H64A C64 H64C 109.5 . . ?
H64B C64 H64C 109.5 . . ?
C62 C65 H65A 109.5 . . ?
C62 C65 H65B 109.5 . . ?
H65A C65 H65B 109.5 . . ?
C62 C65 H65C 109.5 . . ?
H65A C65 H65C 109.5 . . ?
H65B C65 H65C 109.5 . . ?
C62 C66 H66A 109.5 . . ?
C62 C66 H66B 109.5 . . ?
H66A C66 H66B 109.5 . . ?
C62 C66 H66C 109.5 . . ?
H66A C66 H66C 109.5 . . ?
H66B C66 H66C 109.5 . . ?
C63 C67 H67A 109.5 . . ?
C63 C67 H67B 109.5 . . ?
H67A C67 H67B 109.5 . . ?
C63 C67 H67C 109.5 . . ?
H67A C67 H67C 109.5 . . ?
H67B C67 H67C 109.5 . . ?
C63 C68 H68A 109.5 . . ?
C63 C68 H68B 109.5 . . ?
H68A C68 H68B 109.5 . . ?
C63 C68 H68C 109.5 . . ?
H68A C68 H68C 109.5 . . ?
H68B C68 H68C 109.5 . . ?
C63 C69 H69A 109.5 . . ?
C63 C69 H69B 109.5 . . ?
H69A C69 H69B 109.5 . . ?
C63 C69 H69C 109.5 . . ?
H69A C69 H69C 109.5 . . ?
H69B C69 H69C 109.5 . . ?
Cl3 C70 Cl5 113.30(16) . . ?
Cl3 C70 Cl4 109.16(15) . . ?
Cl5 C70 Cl4 109.66(14) . . ?
Cl3 C70 H70 108.2 . . ?
Cl5 C70 H70 108.2 . . ?
Cl4 C70 H70 108.2 . . ?
Cl7 C71 Cl8 111.12(14) . . ?
Cl7 C71 Cl6 110.66(12) . . ?
Cl8 C71 Cl6 109.16(13) . . ?
Cl7 C71 H71 108.6 . . ?
Cl8 C71 H71 108.6 . . ?
Cl6 C71 H71 108.6 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 C1 2.0573(18) . ?
Pt1 N11 2.1075(14) . ?
Pt1 P2 2.2861(4) . ?
Pt1 P3 2.3006(4) . ?
C1 H1A 0.9800 . ?
C1 H1B 0.9800 . ?
C1 H1C 0.9800 . ?
N11 C16 1.358(2) . ?
N11 C12 1.362(2) . ?
C12 C13 1.386(2) . ?
C12 C21 1.499(2) . ?
C13 C14 1.388(2) . ?
C13 H13 0.9500 . ?
C14 C15 1.383(2) . ?
C14 H14 0.9500 . ?
C15 C16 1.390(2) . ?
C15 H15 0.9500 . ?
C16 C31 1.503(2) . ?
P2 C21 1.8359(17) . ?
P2 C22 1.8720(17) . ?
P2 C23 1.8768(18) . ?
C21 H21A 0.9900 . ?
C21 H21B 0.9900 . ?
C22 C26 1.534(3) . ?
C22 C25 1.534(3) . ?
C22 C24 1.539(3) . ?
C23 C28 1.540(3) . ?
C23 C29 1.538(3) . ?
C23 C27 1.539(3) . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?
C29 H29A 0.9800 . ?
C29 H29B 0.9800 . ?
C29 H29C 0.9800 . ?
P3 C31 1.8337(17) . ?
P3 C33 1.8685(18) . ?
P3 C32 1.8799(18) . ?
C31 H31A 0.9900 . ?
C31 H31B 0.9900 . ?
C32 C35 1.533(3) . ?
C32 C36 1.537(3) . ?
C32 C34 1.535(3) . ?
C33 C39 1.537(3) . ?
C33 C38 1.538(3) . ?
C33 C37 1.538(3) . ?
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C35 H35A 0.9800 . ?
C35 H35B 0.9800 . ?
C35 H35C 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 0.9800 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?
C39 H39A 0.9800 . ?
C39 H39B 0.9800 . ?
C39 H39C 0.9800 . ?
Pt2 C2 2.0646(17) . ?
Pt2 N41 2.1098(13) . ?
Pt2 P6 2.2962(4) . ?
Pt2 P5 2.3027(4) . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 H2C 0.9800 . ?
N41 C46 1.359(2) . ?
N41 C42 1.363(2) . ?
C42 C43 1.391(2) . ?
C42 C51 1.496(2) . ?
C43 C44 1.385(2) . ?
C43 H43 0.9500 . ?
C44 C45 1.388(2) . ?
C44 H44 0.9500 . ?
C45 C46 1.389(2) . ?
C45 H45 0.9500 . ?
C46 C61 1.500(2) . ?
P5 C51 1.8352(17) . ?
P5 C52 1.8712(18) . ?
P5 C53 1.8788(18) . ?
C51 H51A 0.9900 . ?
C51 H51B 0.9900 . ?
C52 C55 1.531(3) . ?
C52 C56 1.539(3) . ?
C52 C54 1.540(3) . ?
C53 C58 1.534(3) . ?
C53 C57 1.535(3) . ?
C53 C59 1.537(3) . ?
C54 H54A 0.9800 . ?
C54 H54B 0.9800 . ?
C54 H54C 0.9800 . ?
C55 H55A 0.9800 . ?
C55 H55B 0.9800 . ?
C55 H55C 0.9800 . ?
C56 H56A 0.9800 . ?
C56 H56B 0.9800 . ?
C56 H56C 0.9800 . ?
C57 H57A 0.9800 . ?
C57 H57B 0.9800 . ?
C57 H57C 0.9800 . ?
C58 H58A 0.9800 . ?
C58 H58B 0.9800 . ?
C58 H58C 0.9800 . ?
C59 H59A 0.9800 . ?
C59 H59B 0.9800 . ?
C59 H59C 0.9800 . ?
P6 C61 1.8396(17) . ?
P6 C62 1.8739(17) . ?
P6 C63 1.8777(18) . ?
C61 H61A 0.9900 . ?
C61 H61B 0.9900 . ?
C62 C65 1.533(3) . ?
C62 C64 1.536(3) . ?
C62 C66 1.538(3) . ?
C63 C67 1.538(3) . ?
C63 C68 1.536(3) . ?
C63 C69 1.534(3) . ?
C64 H64A 0.9800 . ?
C64 H64B 0.9800 . ?
C64 H64C 0.9800 . ?
C65 H65A 0.9800 . ?
C65 H65B 0.9800 . ?
C65 H65C 0.9800 . ?
C66 H66A 0.9800 . ?
C66 H66B 0.9800 . ?
C66 H66C 0.9800 . ?
C67 H67A 0.9800 . ?
C67 H67B 0.9800 . ?
C67 H67C 0.9800 . ?
C68 H68A 0.9800 . ?
C68 H68B 0.9800 . ?
C68 H68C 0.9800 . ?
C69 H69A 0.9800 . ?
C69 H69B 0.9800 . ?
C69 H69C 0.9800 . ?
C70 Cl3 1.754(3) . ?
C70 Cl5 1.761(3) . ?
C70 Cl4 1.768(3) . ?
C70 H70 1.0000 . ?
C71 Cl7 1.750(2) . ?
C71 Cl8 1.763(2) . ?
C71 Cl6 1.772(2) . ?
C71 H71 1.0000 . ?
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
P2 Pt1 N11 C16 171.59(12) . . . . ?
P3 Pt1 N11 C16 1.77(12) . . . . ?
P2 Pt1 N11 C12 -2.54(12) . . . . ?
P3 Pt1 N11 C12 -172.36(12) . . . . ?
C16 N11 C12 C13 -3.0(2) . . . . ?
Pt1 N11 C12 C13 171.19(12) . . . . ?
C16 N11 C12 C21 174.52(14) . . . . ?
Pt1 N11 C12 C21 -11.32(19) . . . . ?
N11 C12 C13 C14 0.6(3) . . . . ?
C21 C12 C13 C14 -176.82(16) . . . . ?
C12 C13 C14 C15 1.1(3) . . . . ?
C13 C14 C15 C16 -0.5(3) . . . . ?
C12 N11 C16 C15 3.6(2) . . . . ?
Pt1 N11 C16 C15 -170.57(12) . . . . ?
C12 N11 C16 C31 -173.33(15) . . . . ?
Pt1 N11 C16 C31 12.5(2) . . . . ?
C14 C15 C16 N11 -1.9(3) . . . . ?
C14 C15 C16 C31 175.00(16) . . . . ?
C1 Pt1 P2 C21 -165.77(8) . . . . ?
N11 Pt1 P2 C21 11.74(7) . . . . ?
P3 Pt1 P2 C21 52.43(8) . . . . ?
C1 Pt1 P2 C22 84.24(9) . . . . ?
N11 Pt1 P2 C22 -98.25(7) . . . . ?
P3 Pt1 P2 C22 -57.56(9) . . . . ?
C1 Pt1 P2 C23 -51.39(9) . . . . ?
N11 Pt1 P2 C23 126.12(8) . . . . ?
P3 Pt1 P2 C23 166.81(8) . . . . ?
N11 C12 C21 P2 22.21(19) . . . . ?
C13 C12 C21 P2 -160.29(13) . . . . ?
C22 P2 C21 C12 94.80(13) . . . . ?
C23 P2 C21 C12 -147.16(12) . . . . ?
Pt1 P2 C21 C12 -20.70(12) . . . . ?
C21 P2 C22 C26 68.01(14) . . . . ?
C23 P2 C22 C26 -44.56(15) . . . . ?
Pt1 P2 C22 C26 175.68(11) . . . . ?
C21 P2 C22 C25 -166.42(12) . . . . ?
C23 P2 C22 C25 81.00(14) . . . . ?
Pt1 P2 C22 C25 -58.76(13) . . . . ?
C21 P2 C22 C24 -50.37(14) . . . . ?
C23 P2 C22 C24 -162.94(12) . . . . ?
Pt1 P2 C22 C24 57.30(13) . . . . ?
C21 P2 C23 C28 -37.08(15) . . . . ?
C22 P2 C23 C28 75.29(15) . . . . ?
Pt1 P2 C23 C28 -149.44(12) . . . . ?
C21 P2 C23 C29 -160.08(14) . . . . ?
C22 P2 C23 C29 -47.71(17) . . . . ?
Pt1 P2 C23 C29 87.57(15) . . . . ?
C21 P2 C23 C27 82.12(14) . . . . ?
C22 P2 C23 C27 -165.51(13) . . . . ?
Pt1 P2 C23 C27 -30.23(15) . . . . ?
C1 Pt1 P3 C31 165.95(8) . . . . ?
N11 Pt1 P3 C31 -11.55(7) . . . . ?
P2 Pt1 P3 C31 -52.24(8) . . . . ?
C1 Pt1 P3 C33 52.47(9) . . . . ?
N11 Pt1 P3 C33 -125.03(8) . . . . ?
P2 Pt1 P3 C33 -165.72(8) . . . . ?
C1 Pt1 P3 C32 -83.35(9) . . . . ?
N11 Pt1 P3 C32 99.16(7) . . . . ?
P2 Pt1 P3 C32 58.47(9) . . . . ?
N11 C16 C31 P3 -23.20(19) . . . . ?
C15 C16 C31 P3 159.85(13) . . . . ?
C33 P3 C31 C16 146.25(12) . . . . ?
C32 P3 C31 C16 -94.99(13) . . . . ?
Pt1 P3 C31 C16 20.88(12) . . . . ?
C31 P3 C32 C35 -70.71(15) . . . . ?
C33 P3 C32 C35 42.14(16) . . . . ?
Pt1 P3 C32 C35 -178.51(12) . . . . ?
C31 P3 C32 C36 48.11(14) . . . . ?
C33 P3 C32 C36 160.95(13) . . . . ?
Pt1 P3 C32 C36 -59.69(14) . . . . ?
C31 P3 C32 C34 165.01(13) . . . . ?
C33 P3 C32 C34 -82.14(15) . . . . ?
Pt1 P3 C32 C34 57.21(14) . . . . ?
C31 P3 C33 C39 -76.50(13) . . . . ?
C32 P3 C33 C39 170.27(12) . . . . ?
Pt1 P3 C33 C39 34.92(14) . . . . ?
C31 P3 C33 C38 165.57(13) . . . . ?
C32 P3 C33 C38 52.34(15) . . . . ?
Pt1 P3 C33 C38 -83.01(14) . . . . ?
C31 P3 C33 C37 42.05(14) . . . . ?
C32 P3 C33 C37 -71.18(15) . . . . ?
Pt1 P3 C33 C37 153.47(11) . . . . ?
P6 Pt2 N41 C46 -1.37(12) . . . . ?
P5 Pt2 N41 C46 -172.35(12) . . . . ?
P6 Pt2 N41 C42 173.17(12) . . . . ?
P5 Pt2 N41 C42 2.19(11) . . . . ?
C46 N41 C42 C43 3.8(2) . . . . ?
Pt2 N41 C42 C43 -170.78(12) . . . . ?
C46 N41 C42 C51 -172.92(14) . . . . ?
Pt2 N41 C42 C51 12.47(19) . . . . ?
N41 C42 C43 C44 -2.2(2) . . . . ?
C51 C42 C43 C44 174.48(16) . . . . ?
C42 C43 C44 C45 -0.4(3) . . . . ?
C43 C44 C45 C46 1.4(3) . . . . ?
C42 N41 C46 C45 -2.8(2) . . . . ?
Pt2 N41 C46 C45 171.75(12) . . . . ?
C42 N41 C46 C61 174.32(14) . . . . ?
Pt2 N41 C46 C61 -11.11(19) . . . . ?
C44 C45 C46 N41 0.2(3) . . . . ?
C44 C45 C46 C61 -176.88(16) . . . . ?
C2 Pt2 P5 C51 165.77(8) . . . . ?
N41 Pt2 P5 C51 -12.04(7) . . . . ?
P6 Pt2 P5 C51 -48.44(9) . . . . ?
C2 Pt2 P5 C52 52.39(9) . . . . ?
N41 Pt2 P5 C52 -125.42(8) . . . . ?
P6 Pt2 P5 C52 -161.82(8) . . . . ?
C2 Pt2 P5 C53 -83.65(8) . . . . ?
N41 Pt2 P5 C53 98.55(7) . . . . ?
P6 Pt2 P5 C53 62.15(9) . . . . ?
N41 C42 C51 P5 -23.63(19) . . . . ?
C43 C42 C51 P5 159.59(13) . . . . ?
C52 P5 C51 C42 147.47(12) . . . . ?
C53 P5 C51 C42 -93.90(13) . . . . ?
Pt2 P5 C51 C42 21.54(12) . . . . ?
C51 P5 C52 C55 165.36(14) . . . . ?
C53 P5 C52 C55 52.34(17) . . . . ?
Pt2 P5 C52 C55 -83.05(15) . . . . ?
C51 P5 C52 C56 -76.52(13) . . . . ?
C53 P5 C52 C56 170.46(12) . . . . ?
Pt2 P5 C52 C56 35.07(14) . . . . ?
C51 P5 C52 C54 41.21(15) . . . . ?
C53 P5 C52 C54 -71.81(15) . . . . ?
Pt2 P5 C52 C54 152.80(11) . . . . ?
C51 P5 C53 C58 -69.88(15) . . . . ?
C52 P5 C53 C58 42.55(16) . . . . ?
Pt2 P5 C53 C58 -177.61(12) . . . . ?
C51 P5 C53 C57 165.68(13) . . . . ?
C52 P5 C53 C57 -81.89(14) . . . . ?
Pt2 P5 C53 C57 57.95(14) . . . . ?
C51 P5 C53 C59 48.76(14) . . . . ?
C52 P5 C53 C59 161.19(12) . . . . ?
Pt2 P5 C53 C59 -58.98(13) . . . . ?
C2 Pt2 P6 C61 -167.86(8) . . . . ?
N41 Pt2 P6 C61 9.94(7) . . . . ?
P5 Pt2 P6 C61 46.34(9) . . . . ?
C2 Pt2 P6 C62 82.06(8) . . . . ?
N41 Pt2 P6 C62 -100.14(7) . . . . ?
P5 Pt2 P6 C62 -63.74(9) . . . . ?
C2 Pt2 P6 C63 -54.48(9) . . . . ?
N41 Pt2 P6 C63 123.32(8) . . . . ?
P5 Pt2 P6 C63 159.71(8) . . . . ?
N41 C46 C61 P6 20.23(19) . . . . ?
C45 C46 C61 P6 -162.59(13) . . . . ?
C62 P6 C61 C46 98.04(13) . . . . ?
C63 P6 C61 C46 -143.89(12) . . . . ?
Pt2 P6 C61 C46 -18.20(12) . . . . ?
C61 P6 C62 C65 67.46(14) . . . . ?
C63 P6 C62 C65 -44.30(15) . . . . ?
Pt2 P6 C62 C65 175.53(11) . . . . ?
C61 P6 C62 C64 -168.27(13) . . . . ?
C63 P6 C62 C64 79.97(14) . . . . ?
Pt2 P6 C62 C64 -60.20(13) . . . . ?
C61 P6 C62 C66 -51.72(14) . . . . ?
C63 P6 C62 C66 -163.49(12) . . . . ?
Pt2 P6 C62 C66 56.34(13) . . . . ?
C61 P6 C63 C67 -38.58(14) . . . . ?
C62 P6 C63 C67 73.30(14) . . . . ?
Pt2 P6 C63 C67 -150.40(11) . . . . ?
C61 P6 C63 C68 -161.67(14) . . . . ?
C62 P6 C63 C68 -49.79(16) . . . . ?
Pt2 P6 C63 C68 86.52(14) . . . . ?
C61 P6 C63 C69 80.50(14) . . . . ?
C62 P6 C63 C69 -167.62(12) . . . . ?
Pt2 P6 C63 C69 -31.32(15) . . . . ?
