#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/32/7003247.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_7003247
loop_
_publ_author_name
'Bera, Holger'
'Braunschweig, Holger'
'Dörfler, Rainer'
'Radacki, Krzysztof'
_publ_section_title
;
 Synthesis of a bimetallic platinum--tungsten complex with a bridging
 µ-diboranyl--oxycarbyne moiety
;
_journal_issue                   4
_journal_name_full               'Dalton Transactions'
_journal_page_first              440
_journal_page_last               443
_journal_paper_doi               10.1039/b714763e
_journal_year                    2008
_chemical_formula_moiety         'C48 H46 B2 N2 O3 P2 Pt W'
_chemical_formula_sum            'C48 H46 B2 N2 O3 P2 Pt W'
_chemical_formula_weight         1161.37
_chemical_name_common
;
?
;
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 93.4940(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.4940(2)
_cell_length_b                   24.5737(6)
_cell_length_c                   17.0162(4)
_cell_measurement_reflns_used    9277
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      26.10
_cell_measurement_theta_min      2.37
_cell_volume                     4379.92(17)
_computing_cell_refinement       'Saint+ ver. 7.12A (Bruker AXS)'
_computing_data_collection       'APEX2 ver. 1.0-27 (Bruker AXS)'
_computing_data_reduction        'Saint+ ver. 7.12A (Bruker AXS)'
_computing_molecular_graphics    'XP ver. 5.1 (Bruker AXS, 1998)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  'multi-layer mirror'
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0575
_diffrn_reflns_av_sigmaI/netI    0.0226
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       30
_diffrn_reflns_limit_k_min       -30
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            146108
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.23
_diffrn_reflns_theta_min         2.05
_exptl_absorpt_coefficient_mu    5.932
_exptl_absorpt_correction_T_max  0.59
_exptl_absorpt_correction_T_min  0.37
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Sadabs 2004/1 (Brucker Nonius 2004)'
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.761
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2256
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.09
_refine_diff_density_max         7.537
_refine_diff_density_min         -6.696
_refine_diff_density_rms         0.194
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.098
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     586
_refine_ls_number_reflns         8742
_refine_ls_number_restraints     220
_refine_ls_restrained_S_all      1.085
_refine_ls_R_factor_all          0.0523
_refine_ls_R_factor_gt           0.0458
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0299P)²+78.8464P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1068
_refine_ls_wR_factor_ref         0.1114
_reflns_number_gt                7927
_reflns_number_total             8742
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b714763e.txt
_cod_data_source_block           all
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_Hall     ' '
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7003247
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
W1 W 0.10041(3) 0.114621(13) 0.563206(18) 0.02585(9) Uani 1 1 d . A .
C1A C 0.092(5) 0.0715(16) 0.664(3) 0.0248(17) Uani 0.26(2) 1 d PDU A 1
O1A O 0.117(4) 0.0216(12) 0.692(3) 0.028(2) Uani 0.26(2) 1 d PDU A 1
B1A B 0.223(2) -0.0088(10) 0.6656(19) 0.027(2) Uani 0.26(2) 1 d PDU A 1
N1A N 0.219(4) -0.0641(10) 0.681(3) 0.035(3) Uani 0.26(2) 1 d PDU A 1
C4A C 0.136(5) -0.0910(13) 0.730(3) 0.038(3) Uani 0.26(2) 1 d PDU A 1
H4A1 H 0.0949 -0.0643 0.7624 0.057 Uiso 0.26(2) 1 calc PR A 1
H4A2 H 0.1852 -0.1168 0.7634 0.057 Uiso 0.26(2) 1 calc PR A 1
H4A3 H 0.0709 -0.1107 0.6973 0.057 Uiso 0.26(2) 1 calc PR A 1
C5A C 0.302(5) -0.1012(11) 0.645(3) 0.045(4) Uani 0.26(2) 1 d PDU A 1
H5A1 H 0.2736 -0.1059 0.5891 0.067 Uiso 0.26(2) 1 calc PR A 1
H5A2 H 0.2996 -0.1364 0.6716 0.067 Uiso 0.26(2) 1 calc PR A 1
H5A3 H 0.3889 -0.0868 0.6487 0.067 Uiso 0.26(2) 1 calc PR A 1
B2A B 0.3297(18) 0.0254(12) 0.613(2) 0.030(3) Uani 0.26(2) 1 d PDU A 1
N2A N 0.4620(19) 0.0222(14) 0.630(2) 0.042(3) Uani 0.26(2) 1 d PDU A 1
C6A C 0.517(3) -0.008(2) 0.700(2) 0.059(5) Uani 0.26(2) 1 d PDU A 1
H6A1 H 0.4746 -0.0433 0.7033 0.088 Uiso 0.26(2) 1 calc PR A 1
H6A2 H 0.5026 0.0133 0.7477 0.088 Uiso 0.26(2) 1 calc PR A 1
H6A3 H 0.6084 -0.0131 0.6955 0.088 Uiso 0.26(2) 1 calc PR A 1
C7A C 0.559(2) 0.042(2) 0.579(2) 0.052(4) Uani 0.26(2) 1 d PDU A 1
H7A1 H 0.5193 0.0521 0.5277 0.078 Uiso 0.26(2) 1 calc PR A 1
H7A2 H 0.6236 0.0141 0.5730 0.078 Uiso 0.26(2) 1 calc PR A 1
H7A3 H 0.6003 0.0747 0.6035 0.078 Uiso 0.26(2) 1 calc PR A 1
C11A C 0.271(2) 0.0552(10) 0.5366(17) 0.032(2) Uani 0.26(2) 1 d PDU A 1
C12A C 0.298(3) 0.1064(13) 0.504(2) 0.037(3) Uani 0.26(2) 1 d PDU A 1
H12A H 0.3701 0.1283 0.5183 0.045 Uiso 0.26(2) 1 calc PR A 1
C13A C 0.201(4) 0.1202(16) 0.447(2) 0.042(3) Uani 0.26(2) 1 d PDU A 1
H13A H 0.1958 0.1527 0.4166 0.051 Uiso 0.26(2) 1 calc PR A 1
C14A C 0.112(4) 0.0777(19) 0.442(2) 0.037(3) Uani 0.26(2) 1 d PDU A 1
H14A H 0.0365 0.0760 0.4088 0.045 Uiso 0.26(2) 1 calc PR A 1
C15A C 0.155(3) 0.0386(14) 0.496(2) 0.029(2) Uani 0.26(2) 1 d PDU A 1
H15A H 0.1127 0.0052 0.5044 0.035 Uiso 0.26(2) 1 calc PR A 1
C1B C 0.1023(18) 0.0699(6) 0.6599(10) 0.0248(17) Uani 0.74(2) 1 d PDU A 2
O1B O 0.1452(13) 0.0226(4) 0.6898(9) 0.028(2) Uani 0.74(2) 1 d PDU A 2
B1B B 0.2460(13) -0.0060(5) 0.6546(8) 0.027(2) Uani 0.74(2) 1 d PDU A 2
N1B N 0.2556(14) -0.0607(4) 0.6741(9) 0.035(3) Uani 0.74(2) 1 d PDU A 2
C4B C 0.1757(15) -0.0900(5) 0.7219(11) 0.038(3) Uani 0.74(2) 1 d PDU A 2
H4B1 H 0.0980 -0.0689 0.7292 0.057 Uiso 0.74(2) 1 calc PR A 2
H4B2 H 0.2204 -0.0967 0.7732 0.057 Uiso 0.74(2) 1 calc PR A 2
H4B3 H 0.1529 -0.1248 0.6967 0.057 Uiso 0.74(2) 1 calc PR A 2
C5B C 0.3489(17) -0.0949(5) 0.6420(11) 0.045(4) Uani 0.74(2) 1 d PDU A 2
H5B1 H 0.3922 -0.0750 0.6014 0.067 Uiso 0.74(2) 1 calc PR A 2
H5B2 H 0.3071 -0.1272 0.6186 0.067 Uiso 0.74(2) 1 calc PR A 2
H5B3 H 0.4117 -0.1061 0.6839 0.067 Uiso 0.74(2) 1 calc PR A 2
B2B B 0.3357(11) 0.0297(6) 0.5924(9) 0.030(3) Uani 0.74(2) 1 d PDU A 2
N2B N 0.4675(9) 0.0375(6) 0.6068(9) 0.042(3) Uani 0.74(2) 1 d PDU A 2
C6B C 0.5376(14) 0.0145(8) 0.6779(11) 0.059(5) Uani 0.74(2) 1 d PDU A 2
H6B1 H 0.4763 0.0005 0.7141 0.088 Uiso 0.74(2) 1 calc PR A 2
H6B2 H 0.5896 0.0431 0.7042 0.088 Uiso 0.74(2) 1 calc PR A 2
H6B3 H 0.5930 -0.0151 0.6622 0.088 Uiso 0.74(2) 1 calc PR A 2
C7B C 0.5513(13) 0.0640(7) 0.5529(12) 0.052(4) Uani 0.74(2) 1 d PDU A 2
H7B1 H 0.5089 0.0652 0.5000 0.078 Uiso 0.74(2) 1 calc PR A 2
H7B2 H 0.6311 0.0435 0.5516 0.078 Uiso 0.74(2) 1 calc PR A 2
H7B3 H 0.5699 0.1012 0.5711 0.078 Uiso 0.74(2) 1 calc PR A 2
C11B C 0.2590(11) 0.0570(5) 0.5201(7) 0.032(2) Uani 0.74(2) 1 d PDU A 2
C12B C 0.2707(14) 0.1084(5) 0.4845(9) 0.037(3) Uani 0.74(2) 1 d PDU A 2
H12B H 0.3409 0.1325 0.4934 0.045 Uiso 0.74(2) 1 calc PR A 2
C13B C 0.1625(16) 0.1186(6) 0.4337(8) 0.042(3) Uani 0.74(2) 1 d PDU A 2
H13B H 0.1471 0.1504 0.4030 0.051 Uiso 0.74(2) 1 calc PR A 2
C14B C 0.0816(15) 0.0736(7) 0.4363(9) 0.037(3) Uani 0.74(2) 1 d PDU A 2
H14B H 0.0014 0.0693 0.4080 0.045 Uiso 0.74(2) 1 calc PR A 2
C15B C 0.1398(12) 0.0366(6) 0.4878(8) 0.029(2) Uani 0.74(2) 1 d PDU A 2
H15B H 0.1051 0.0021 0.5001 0.035 Uiso 0.74(2) 1 calc PR A 2
C2 C 0.1486(8) 0.1865(3) 0.6010(5) 0.0284(17) Uani 1 1 d . A .
O2 O 0.1897(6) 0.2299(3) 0.6176(4) 0.0450(17) Uani 1 1 d . . .
C3 C -0.0805(9) 0.1345(3) 0.5508(5) 0.0307(18) Uani 1 1 d . A .
O3 O -0.1883(6) 0.1441(3) 0.5352(4) 0.0469(17) Uani 1 1 d . . .
Pt1 Pt 0.00670(3) 0.129121(11) 0.710765(15) 0.01841(8) Uani 1 1 d . . .
P1 P -0.00288(18) 0.08446(7) 0.82595(10) 0.0187(4) Uani 1 1 d . A .
P2 P -0.08905(18) 0.21270(7) 0.73554(11) 0.0189(4) Uani 1 1 d . A .
C21 C 0.1571(7) 0.0608(3) 0.8599(4) 0.0198(14) Uani 1 1 d . . .
C22 C 0.2610(8) 0.0948(3) 0.8479(5) 0.0282(17) Uani 1 1 d . A .
H22A H 0.2468 0.1296 0.8245 0.034 Uiso 1 1 calc R . .
C23 C 0.3844(8) 0.0784(4) 0.8697(5) 0.0326(18) Uani 1 1 d . . .
H23A H 0.4542 0.1018 0.8614 0.039 Uiso 1 1 calc R A .
C24 C 0.4057(8) 0.0278(4) 0.9038(5) 0.0293(17) Uani 1 1 d . A .
H24A H 0.4904 0.0163 0.9183 0.035 Uiso 1 1 calc R . .
C25 C 0.3040(8) -0.0060(3) 0.9165(5) 0.0293(18) Uani 1 1 d . . .
H25A H 0.3189 -0.0406 0.9401 0.035 Uiso 1 1 calc R A .
C26 C 0.1810(8) 0.0102(3) 0.8954(4) 0.0228(15) Uani 1 1 d . A .
H26A H 0.1117 -0.0133 0.9050 0.027 Uiso 1 1 calc R . .
C31 C -0.0985(7) 0.0220(3) 0.8210(4) 0.0224(15) Uani 1 1 d . . .
C32 C -0.1288(8) -0.0032(4) 0.7500(5) 0.0323(19) Uani 1 1 d . A .
H32A H -0.1047 0.0130 0.7024 0.039 Uiso 1 1 calc R . .
C33 C -0.1950(9) -0.0527(4) 0.7479(6) 0.043(2) Uani 1 1 d . . .
H33A H -0.2121 -0.0709 0.6991 0.052 Uiso 1 1 calc R A .
C34 C -0.2352(9) -0.0749(4) 0.8154(6) 0.040(2) Uani 1 1 d . A .
H34A H -0.2807 -0.1084 0.8134 0.047 Uiso 1 1 calc R . .
C35 C -0.2105(8) -0.0494(3) 0.8858(5) 0.0326(18) Uani 1 1 d . . .
H35A H -0.2407 -0.0647 0.9325 0.039 Uiso 1 1 calc R A .
C36 C -0.1413(8) -0.0013(3) 0.8895(5) 0.0272(17) Uani 1 1 d . A .
H36A H -0.1230 0.0159 0.9389 0.033 Uiso 1 1 calc R . .
C41 C -0.0636(8) 0.1153(3) 0.9138(4) 0.0227(15) Uani 1 1 d . . .
C42 C -0.1948(9) 0.1258(3) 0.9142(5) 0.0315(18) Uani 1 1 d . A .
H42A H -0.2486 0.1185 0.8685 0.038 Uiso 1 1 calc R . .
C43 C -0.2468(9) 0.1468(4) 0.9809(5) 0.036(2) Uani 1 1 d . . .
H43A H -0.3360 0.1536 0.9806 0.044 Uiso 1 1 calc R A .
C44 C -0.1700(11) 0.1578(4) 1.0474(5) 0.043(2) Uani 1 1 d . A .
H44A H -0.2057 0.1723 1.0929 0.052 Uiso 1 1 calc R . .
C45 C -0.0406(11) 0.1478(4) 1.0474(5) 0.042(2) Uani 1 1 d . . .
H45A H 0.0124 0.1548 1.0936 0.051 Uiso 1 1 calc R A .
C46 C 0.0130(9) 0.1275(3) 0.9807(5) 0.0304(18) Uani 1 1 d . A .
H46A H 0.1027 0.1220 0.9810 0.036 Uiso 1 1 calc R . .
C51 C -0.0673(7) 0.2720(3) 0.6713(4) 0.0208(15) Uani 1 1 d . . .
C52 C -0.1298(8) 0.2723(3) 0.5965(5) 0.0275(17) Uani 1 1 d . A .
H52A H -0.1815 0.2421 0.5800 0.033 Uiso 1 1 calc R . .
C53 C -0.1171(8) 0.3160(3) 0.5459(5) 0.0287(17) Uani 1 1 d . . .
H53A H -0.1610 0.3158 0.4953 0.034 Uiso 1 1 calc R A .
C54 C -0.0414(8) 0.3596(3) 0.5686(5) 0.0266(17) Uani 1 1 d . A .
H54A H -0.0327 0.3895 0.5340 0.032 Uiso 1 1 calc R . .
C55 C 0.0218(8) 0.3596(3) 0.6422(5) 0.0304(18) Uani 1 1 d . . .
H55A H 0.0744 0.3895 0.6583 0.036 Uiso 1 1 calc R A .
C56 C 0.0089(8) 0.3159(3) 0.6927(5) 0.0271(17) Uani 1 1 d . A .
H56A H 0.0533 0.3163 0.7431 0.033 Uiso 1 1 calc R . .
C61 C -0.2632(8) 0.2128(3) 0.7350(4) 0.0259(16) Uani 1 1 d . . .
C62 C -0.3315(8) 0.2607(4) 0.7448(5) 0.036(2) Uani 1 1 d . A .
H62A H -0.2871 0.2940 0.7543 0.044 Uiso 1 1 calc R . .
C63 C -0.4650(9) 0.2600(5) 0.7407(6) 0.050(3) Uani 1 1 d . . .
H63A H -0.5112 0.2926 0.7491 0.060 Uiso 1 1 calc R A .
C64 C -0.5295(10) 0.2120(5) 0.7244(6) 0.054(3) Uani 1 1 d . A .
H64A H -0.6202 0.2117 0.7205 0.064 Uiso 1 1 calc R . .
C65 C -0.4634(9) 0.1647(5) 0.7138(6) 0.048(3) Uani 1 1 d . . .
H65A H -0.5084 0.1318 0.7030 0.057 Uiso 1 1 calc R A .
C66 C -0.3306(8) 0.1649(4) 0.7189(5) 0.0338(19) Uani 1 1 d . A .
H66A H -0.2854 0.1320 0.7112 0.041 Uiso 1 1 calc R . .
C71 C -0.0324(8) 0.2393(3) 0.8316(4) 0.0221(15) Uani 1 1 d . . .
C72 C -0.1105(8) 0.2531(3) 0.8916(5) 0.0267(17) Uani 1 1 d . A .
H72A H -0.2007 0.2508 0.8829 0.032 Uiso 1 1 calc R . .
C73 C -0.0575(9) 0.2702(3) 0.9641(5) 0.0338(19) Uani 1 1 d . . .
H73A H -0.1117 0.2779 1.0054 0.041 Uiso 1 1 calc R A .
C74 C 0.0714(9) 0.2761(3) 0.9768(5) 0.0338(19) Uani 1 1 d . A .
H74A H 0.1062 0.2896 1.0258 0.041 Uiso 1 1 calc R . .
C75 C 0.1515(8) 0.2625(3) 0.9181(5) 0.0299(18) Uani 1 1 d . . .
H75A H 0.2412 0.2667 0.9268 0.036 Uiso 1 1 calc R A .
C76 C 0.1008(8) 0.2428(3) 0.8468(5) 0.0252(16) Uani 1 1 d . A .
H76A H 0.1562 0.2315 0.8078 0.030 Uiso 1 1 calc R . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0013 0.0007 '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'
O O 0.0106 0.0060 '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'
W W -0.8490 6.8722 '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
C2 W1 C3 92.3(3) . . ?
C2 W1 C1B 104.0(7) . . ?
C3 W1 C1B 100.9(5) . . ?
C2 W1 C1A 102.7(17) . . ?
C3 W1 C1A 97.4(13) . . ?
C1B W1 C1A 3.8(9) . . ?
C2 W1 C14A 129.9(11) . . ?
C3 W1 C14A 96.2(9) . . ?
C1B W1 C14A 122.4(10) . . ?
C1A W1 C14A 124.8(17) . . ?
C2 W1 C15A 147.6(8) . . ?
C3 W1 C15A 114.9(7) . . ?
C1B W1 C15A 88.4(10) . . ?
C1A W1 C15A 91.4(10) . . ?
C14A W1 C15A 35.4(8) . . ?
C2 W1 C13A 96.2(11) . . ?
C3 W1 C13A 112.5(9) . . ?
C1B W1 C13A 140.1(8) . . ?
C1A W1 C13A 143.9(11) . . ?
C14A W1 C13A 35.6(7) . . ?
C15A W1 C13A 58.3(10) . . ?
C2 W1 C12B 93.3(4) . . ?
C3 W1 C12B 137.3(5) . . ?
C1B W1 C12B 118.5(5) . . ?
C1A W1 C12B 122.3(9) . . ?
C14A W1 C12B 49.9(10) . . ?
C15A W1 C12B 55.0(10) . . ?
C13A W1 C12B 24.8(8) . . ?
C2 W1 C11B 118.7(4) . . ?
C3 W1 C11B 145.2(4) . . ?
C1B W1 C11B 87.3(4) . . ?
C1A W1 C11B 91.1(7) . . ?
C14A W1 C11B 52.5(9) . . ?
C15A W1 C11B 30.8(8) . . ?
C13A W1 C11B 52.8(9) . . ?
C12B W1 C11B 35.4(4) . . ?
C2 W1 C13B 101.1(5) . . ?
C3 W1 C13B 102.2(5) . . ?
C1B W1 C13B 144.9(5) . . ?
C1A W1 C13B 148.3(8) . . ?
C14A W1 C13B 28.9(12) . . ?
C15A W1 C13B 57.8(10) . . ?
C13A W1 C13B 11.0(9) . . ?
C12B W1 C13B 35.3(4) . . ?
C11B W1 C13B 59.0(4) . . ?
C2 W1 C15B 150.6(4) . . ?
C3 W1 C15B 110.2(4) . . ?
C1B W1 C15B 90.4(5) . . ?
C1A W1 C15B 93.2(12) . . ?
C14A W1 C15B 32.5(12) . . ?
C15A W1 C15B 4.8(7) . . ?
C13A W1 C15B 58.4(12) . . ?
C12B W1 C15B 57.4(4) . . ?
C11B W1 C15B 35.4(3) . . ?
C13B W1 C15B 56.8(4) . . ?
C2 W1 C12A 90.1(9) . . ?
C3 W1 C12A 147.4(8) . . ?
C1B W1 C12A 110.0(7) . . ?
C1A W1 C12A 113.7(14) . . ?
C14A W1 C12A 58.7(9) . . ?
C15A W1 C12A 57.5(8) . . ?
C13A W1 C12A 35.1(6) . . ?
C12B W1 C12A 10.3(8) . . ?
C11B W1 C12A 32.5(9) . . ?
C13B W1 C12A 45.6(8) . . ?
C15B W1 C12A 60.8(10) . . ?
O1A C1A Pt1 129.3(18) . . ?
O1A C1A W1 140(3) . . ?
Pt1 C1A W1 90.6(11) . . ?
C1A O1A B1A 120.5(8) . . ?
N1A B1A O1A 114.8(10) . . ?
N1A B1A B2A 127.7(9) . . ?
O1A B1A B2A 117.2(8) . . ?
B1A N1A C4A 126.9(10) . . ?
B1A N1A C5A 121.4(10) . . ?
C4A N1A C5A 111.7(9) . . ?
N2A B2A C11A 121.8(11) . . ?
N2A B2A B1A 122.5(10) . . ?
C11A B2A B1A 115.3(8) . . ?
B2A N2A C7A 125.2(12) . . ?
B2A N2A C6A 121.5(12) . . ?
C7A N2A C6A 113.1(11) . . ?
C12A C11A C15A 104.3(10) . . ?
C12A C11A B2A 131.4(10) . . ?
C15A C11A B2A 123.0(9) . . ?
C12A C11A W1 72.3(10) . . ?
C15A C11A W1 68.5(15) . . ?
B2A C11A W1 112.8(11) . . ?
C13A C12A C11A 109.6(10) . . ?
C13A C12A W1 70.0(13) . . ?
C11A C12A W1 73.2(8) . . ?
C13A C12A H12A 125.2 . . ?
C11A C12A H12A 125.2 . . ?
W1 C12A H12A 123.2 . . ?
C14A C13A C12A 108.0(9) . . ?
C14A C13A W1 70.5(15) . . ?
C12A C13A W1 75.0(13) . . ?
C14A C13A H13A 126.0 . . ?
C12A C13A H13A 126.0 . . ?
W1 C13A H13A 120.3 . . ?
C15A C14A C13A 107.2(10) . . ?
C15A C14A W1 73.3(8) . . ?
C13A C14A W1 73.9(13) . . ?
C15A C14A H14A 126.4 . . ?
C13A C14A H14A 126.4 . . ?
W1 C14A H14A 118.4 . . ?
C14A C15A C11A 110.9(9) . . ?
C14A C15A W1 71.3(11) . . ?
C11A C15A W1 75.9(13) . . ?
C14A C15A H15A 124.5 . . ?
C11A C15A H15A 124.5 . . ?
W1 C15A H15A 119.8 . . ?
O1B C1B W1 141.9(9) . . ?
O1B C1B Pt1 129.5(9) . . ?
W1 C1B Pt1 88.6(5) . . ?
C1B O1B B1B 120.5(8) . . ?
N1B B1B O1B 114.8(9) . . ?
N1B B1B B2B 127.9(9) . . ?
O1B B1B B2B 117.3(7) . . ?
B1B N1B C4B 126.8(9) . . ?
B1B N1B C5B 121.5(10) . . ?
C4B N1B C5B 111.6(9) . . ?
N1B C4B H4B1 109.5 . . ?
N1B C4B H4B2 109.5 . . ?
H4B1 C4B H4B2 109.5 . . ?
N1B C4B H4B3 109.5 . . ?
H4B1 C4B H4B3 109.5 . . ?
H4B2 C4B H4B3 109.5 . . ?
N1B C5B H5B1 109.5 . . ?
N1B C5B H5B2 109.5 . . ?
H5B1 C5B H5B2 109.5 . . ?
N1B C5B H5B3 109.5 . . ?
H5B1 C5B H5B3 109.5 . . ?
H5B2 C5B H5B3 109.5 . . ?
N2B B2B C11B 121.9(10) . . ?
N2B B2B B1B 122.6(10) . . ?
C11B B2B B1B 115.4(8) . . ?
B2B N2B C7B 125.2(12) . . ?
B2B N2B C6B 121.5(11) . . ?
C7B N2B C6B 113.1(11) . . ?
N2B C6B H6B1 109.5 . . ?
N2B C6B H6B2 109.5 . . ?
H6B1 C6B H6B2 109.5 . . ?
N2B C6B H6B3 109.5 . . ?
H6B1 C6B H6B3 109.5 . . ?
H6B2 C6B H6B3 109.5 . . ?
N2B C7B H7B1 109.5 . . ?
N2B C7B H7B2 109.5 . . ?
H7B1 C7B H7B2 109.5 . . ?
N2B C7B H7B3 109.5 . . ?
H7B1 C7B H7B3 109.5 . . ?
H7B2 C7B H7B3 109.5 . . ?
C12B C11B C15B 104.3(9) . . ?
C12B C11B B2B 131.5(10) . . ?
C15B C11B B2B 123.0(8) . . ?
C12B C11B W1 71.0(6) . . ?
C15B C11B W1 73.1(7) . . ?
B2B C11B W1 110.6(6) . . ?
C13B C12B C11B 109.6(9) . . ?
C13B C12B W1 73.7(7) . . ?
C11B C12B W1 73.7(5) . . ?
C13B C12B H12B 125.2 . . ?
C11B C12B H12B 125.2 . . ?
W1 C12B H12B 119.2 . . ?
C14B C13B C12B 108.0(9) . . ?
C14B C13B W1 74.5(7) . . ?
C12B C13B W1 71.0(6) . . ?
C14B C13B H13B 126.0 . . ?
C12B C13B H13B 126.0 . . ?
W1 C13B H13B 120.3 . . ?
C15B C14B C13B 107.2(10) . . ?
C15B C14B W1 72.2(5) . . ?
C13B C14B W1 71.1(7) . . ?
C15B C14B H14B 126.4 . . ?
C13B C14B H14B 126.4 . . ?
W1 C14B H14B 122.0 . . ?
C14B C15B C11B 110.9(9) . . ?
C14B C15B W1 74.0(6) . . ?
C11B C15B W1 71.5(6) . . ?
C14B C15B H15B 124.5 . . ?
C11B C15B H15B 124.5 . . ?
W1 C15B H15B 121.6 . . ?
O2 C2 W1 171.8(7) . . ?
O3 C3 W1 172.6(8) . . ?
C1A Pt1 C1B 2.2(19) . . ?
C1A Pt1 P1 92.7(9) . . ?
C1B Pt1 P1 94.1(4) . . ?
C1A Pt1 P2 164.0(9) . . ?
C1B Pt1 P2 162.4(3) . . ?
P1 Pt1 P2 103.22(6) . . ?
C1A Pt1 W1 46.9(9) . . ?
C1B Pt1 W1 45.4(4) . . ?
P1 Pt1 W1 139.59(5) . . ?
P2 Pt1 W1 117.14(5) . . ?
C41 P1 C31 99.7(3) . . ?
C41 P1 C21 103.4(3) . . ?
C31 P1 C21 103.7(3) . . ?
C41 P1 Pt1 123.1(2) . . ?
C31 P1 Pt1 114.9(2) . . ?
C21 P1 Pt1 109.8(2) . . ?
C71 P2 C61 106.0(4) . . ?
C71 P2 C51 101.7(3) . . ?
C61 P2 C51 99.0(3) . . ?
C71 P2 Pt1 110.9(2) . . ?
C61 P2 Pt1 116.2(3) . . ?
C51 P2 Pt1 121.2(2) . . ?
C22 C21 C26 118.3(7) . . ?
C22 C21 P1 118.1(6) . . ?
C26 C21 P1 123.6(6) . . ?
C23 C22 C21 120.7(8) . . ?
C23 C22 H22A 119.6 . . ?
C21 C22 H22A 119.6 . . ?
C24 C23 C22 120.0(8) . . ?
C24 C23 H23A 120.0 . . ?
C22 C23 H23A 120.0 . . ?
C25 C24 C23 119.9(8) . . ?
C25 C24 H24A 120.0 . . ?
C23 C24 H24A 120.0 . . ?
C26 C25 C24 120.5(8) . . ?
C26 C25 H25A 119.7 . . ?
C24 C25 H25A 119.7 . . ?
C25 C26 C21 120.6(7) . . ?
C25 C26 H26A 119.7 . . ?
C21 C26 H26A 119.7 . . ?
C32 C31 C36 118.6(7) . . ?
C32 C31 P1 120.9(6) . . ?
C36 C31 P1 120.5(6) . . ?
C31 C32 C33 120.0(8) . . ?
C31 C32 H32A 120.0 . . ?
C33 C32 H32A 120.0 . . ?
C34 C33 C32 120.3(8) . . ?
C34 C33 H33A 119.8 . . ?
C32 C33 H33A 119.8 . . ?
C33 C34 C35 120.4(8) . . ?
C33 C34 H34A 119.8 . . ?
C35 C34 H34A 119.8 . . ?
C34 C35 C36 120.2(8) . . ?
C34 C35 H35A 119.9 . . ?
C36 C35 H35A 119.9 . . ?
C35 C36 C31 120.3(8) . . ?
C35 C36 H36A 119.8 . . ?
C31 C36 H36A 119.8 . . ?
C46 C41 C42 118.5(7) . . ?
C46 C41 P1 123.3(6) . . ?
C42 C41 P1 118.2(6) . . ?
C43 C42 C41 120.5(8) . . ?
C43 C42 H42A 119.7 . . ?
C41 C42 H42A 119.7 . . ?
C44 C43 C42 120.4(9) . . ?
C44 C43 H43A 119.8 . . ?
C42 C43 H43A 119.8 . . ?
C43 C44 C45 119.5(8) . . ?
C43 C44 H44A 120.2 . . ?
C45 C44 H44A 120.2 . . ?
C44 C45 C46 120.7(9) . . ?
C44 C45 H45A 119.6 . . ?
C46 C45 H45A 119.6 . . ?
C41 C46 C45 120.3(9) . . ?
C41 C46 H46A 119.8 . . ?
C45 C46 H46A 119.8 . . ?
C56 C51 C52 118.0(7) . . ?
C56 C51 P2 123.5(6) . . ?
C52 C51 P2 118.4(6) . . ?
C53 C52 C51 120.8(7) . . ?
C53 C52 H52A 119.6 . . ?
C51 C52 H52A 119.6 . . ?
C54 C53 C52 120.3(7) . . ?
C54 C53 H53A 119.9 . . ?
C52 C53 H53A 119.9 . . ?
C53 C54 C55 119.4(7) . . ?
C53 C54 H54A 120.3 . . ?
C55 C54 H54A 120.3 . . ?
C54 C55 C56 120.2(8) . . ?
C54 C55 H55A 119.9 . . ?
C56 C55 H55A 119.9 . . ?
C51 C56 C55 121.3(7) . . ?
C51 C56 H56A 119.4 . . ?
C55 C56 H56A 119.4 . . ?
C66 C61 C62 118.7(8) . . ?
C66 C61 P2 119.8(6) . . ?
C62 C61 P2 121.4(7) . . ?
C61 C62 C63 120.3(10) . . ?
C61 C62 H62A 119.9 . . ?
C63 C62 H62A 119.9 . . ?
C64 C63 C62 119.9(10) . . ?
C64 C63 H63A 120.1 . . ?
C62 C63 H63A 120.1 . . ?
C65 C64 C63 120.3(9) . . ?
C65 C64 H64A 119.8 . . ?
C63 C64 H64A 119.8 . . ?
C64 C65 C66 120.2(10) . . ?
C64 C65 H65A 119.9 . . ?
C66 C65 H65A 119.9 . . ?
C61 C66 C65 120.6(9) . . ?
C61 C66 H66A 119.7 . . ?
C65 C66 H66A 119.7 . . ?
C72 C71 C76 118.3(7) . . ?
C72 C71 P2 124.8(6) . . ?
C76 C71 P2 116.8(6) . . ?
C73 C72 C71 120.3(8) . . ?
C73 C72 H72A 119.9 . . ?
C71 C72 H72A 119.9 . . ?
C74 C73 C72 120.9(8) . . ?
C74 C73 H73A 119.6 . . ?
C72 C73 H73A 119.6 . . ?
C73 C74 C75 120.0(8) . . ?
C73 C74 H74A 120.0 . . ?
C75 C74 H74A 120.0 . . ?
C76 C75 C74 120.0(8) . . ?
C76 C75 H75A 120.0 . . ?
C74 C75 H75A 120.0 . . ?
C75 C76 C71 120.4(8) . . ?
C75 C76 H76A 119.8 . . ?
C71 C76 H76A 119.8 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
W1 C2 1.937(8) . ?
W1 C3 1.959(9) . ?
W1 C1B 1.978(12) . ?
W1 C1A 2.03(3) . ?
W1 C14A 2.26(5) . ?
W1 C15A 2.28(4) . ?
W1 C13A 2.30(4) . ?
W1 C12B 2.302(13) . ?
W1 C11B 2.337(11) . ?
W1 C13B 2.338(13) . ?
W1 C15B 2.358(15) . ?
W1 C12A 2.37(3) . ?
C1A O1A 1.337(10) . ?
C1A Pt1 1.87(3) . ?
O1A B1A 1.432(12) . ?
B1A N1A 1.385(13) . ?
B1A B2A 1.702(17) . ?
N1A C4A 1.403(15) . ?
N1A C5A 1.425(14) . ?
C4A H4A1 0.9800 . ?
C4A H4A2 0.9800 . ?
C4A H4A3 0.9800 . ?
C5A H5A1 0.9800 . ?
C5A H5A2 0.9800 . ?
C5A H5A3 0.9800 . ?
B2A N2A 1.404(14) . ?
B2A C11A 1.578(16) . ?
N2A C7A 1.462(17) . ?
N2A C6A 1.488(18) . ?
C6A H6A1 0.9800 . ?
C6A H6A2 0.9800 . ?
C6A H6A3 0.9800 . ?
C7A H7A1 0.9800 . ?
C7A H7A2 0.9800 . ?
C7A H7A3 0.9800 . ?
C11A C12A 1.410(14) . ?
C11A C15A 1.426(13) . ?
C12A C13A 1.407(17) . ?
C12A H12A 0.9500 . ?
C13A C14A 1.396(15) . ?
C13A H13A 0.9500 . ?
C14A C15A 1.379(13) . ?
C14A H14A 0.9500 . ?
C15A H15A 0.9500 . ?
C1B O1B 1.337(10) . ?
C1B Pt1 1.995(11) . ?
O1B B1B 1.432(12) . ?
B1B N1B 1.385(13) . ?
B1B B2B 1.702(17) . ?
N1B C4B 1.403(15) . ?
N1B C5B 1.425(14) . ?
C4B H4B1 0.9800 . ?
C4B H4B2 0.9800 . ?
C4B H4B3 0.9800 . ?
C5B H5B1 0.9800 . ?
C5B H5B2 0.9800 . ?
C5B H5B3 0.9800 . ?
B2B N2B 1.404(14) . ?
B2B C11B 1.578(16) . ?
N2B C7B 1.462(17) . ?
N2B C6B 1.488(18) . ?
C6B H6B1 0.9800 . ?
C6B H6B2 0.9800 . ?
C6B H6B3 0.9800 . ?
C7B H7B1 0.9800 . ?
C7B H7B2 0.9800 . ?
C7B H7B3 0.9800 . ?
C11B C12B 1.410(14) . ?
C11B C15B 1.426(13) . ?
C12B C13B 1.407(17) . ?
C12B H12B 0.9500 . ?
C13B C14B 1.396(15) . ?
C13B H13B 0.9500 . ?
C14B C15B 1.379(13) . ?
C14B H14B 0.9500 . ?
C15B H15B 0.9500 . ?
C2 O2 1.177(10) . ?
C3 O3 1.169(11) . ?
Pt1 P1 2.2540(18) . ?
Pt1 P2 2.3361(18) . ?
P1 C41 1.825(7) . ?
P1 C31 1.833(8) . ?
P1 C21 1.836(8) . ?
P2 C71 1.826(8) . ?
P2 C61 1.827(8) . ?
P2 C51 1.844(7) . ?
C21 C22 1.398(11) . ?
C21 C26 1.400(10) . ?
C22 C23 1.385(12) . ?
C22 H22A 0.9500 . ?
C23 C24 1.384(12) . ?
C23 H23A 0.9500 . ?
C24 C25 1.379(12) . ?
C24 H24A 0.9500 . ?
C25 C26 1.378(11) . ?
C25 H25A 0.9500 . ?
C26 H26A 0.9500 . ?
C31 C32 1.377(11) . ?
C31 C36 1.398(11) . ?
C32 C33 1.401(13) . ?
C32 H32A 0.9500 . ?
C33 C34 1.362(14) . ?
C33 H33A 0.9500 . ?
C34 C35 1.362(13) . ?
C34 H34A 0.9500 . ?
C35 C36 1.387(11) . ?
C35 H35A 0.9500 . ?
C36 H36A 0.9500 . ?
C41 C46 1.387(11) . ?
C41 C42 1.401(12) . ?
C42 C43 1.388(12) . ?
C42 H42A 0.9500 . ?
C43 C44 1.376(14) . ?
C43 H43A 0.9500 . ?
C44 C45 1.380(15) . ?
C44 H44A 0.9500 . ?
C45 C46 1.389(12) . ?
C45 H45A 0.9500 . ?
C46 H46A 0.9500 . ?
C51 C56 1.379(11) . ?
C51 C52 1.395(11) . ?
C52 C53 1.389(11) . ?
C52 H52A 0.9500 . ?
C53 C54 1.375(12) . ?
C53 H53A 0.9500 . ?
C54 C55 1.382(12) . ?
C54 H54A 0.9500 . ?
C55 C56 1.386(11) . ?
C55 H55A 0.9500 . ?
C56 H56A 0.9500 . ?
C61 C66 1.391(12) . ?
C61 C62 1.395(12) . ?
C62 C63 1.399(13) . ?
C62 H62A 0.9500 . ?
C63 C64 1.380(17) . ?
C63 H63A 0.9500 . ?
C64 C65 1.371(16) . ?
C64 H64A 0.9500 . ?
C65 C66 1.392(13) . ?
C65 H65A 0.9500 . ?
C66 H66A 0.9500 . ?
C71 C72 1.389(11) . ?
C71 C76 1.409(11) . ?
C72 C73 1.387(12) . ?
C72 H72A 0.9500 . ?
C73 C74 1.365(13) . ?
C73 H73A 0.9500 . ?
C74 C75 1.385(12) . ?
C74 H74A 0.9500 . ?
C75 C76 1.382(11) . ?
C75 H75A 0.9500 . ?
C76 H76A 0.9500 . ?
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
C2 W1 C1A O1A -144(7) . . . . ?
C3 W1 C1A O1A 122(8) . . . . ?
C14A W1 C1A O1A 19(8) . . . . ?
C15A W1 C1A O1A 7(8) . . . . ?
C13A W1 C1A O1A -24(11) . . . . ?
C12A W1 C1A O1A -48(8) . . . . ?
C2 W1 C1A Pt1 43(2) . . . . ?
C3 W1 C1A Pt1 -51(2) . . . . ?
C14A W1 C1A Pt1 -153.6(18) . . . . ?
C15A W1 C1A Pt1 -166(2) . . . . ?
C13A W1 C1A Pt1 163(2) . . . . ?
C12A W1 C1A Pt1 139.1(19) . . . . ?
W1 C1A O1A B1A 34(11) . . . . ?
C1A O1A B1A N1A -162(6) . . . . ?
C1A O1A B1A B2A 12(7) . . . . ?
O1A B1A N1A C4A -12(6) . . . . ?
B2A B1A N1A C4A 174(4) . . . . ?
O1A B1A N1A C5A 168(5) . . . . ?
B2A B1A N1A C5A -6(6) . . . . ?
N1A B1A B2A N2A -55(4) . . . . ?
O1A B1A B2A N2A 131(4) . . . . ?
N1A B1A B2A C11A 117(4) . . . . ?
O1A B1A B2A C11A -56(2) . . . . ?
C11A B2A N2A C7A -4(4) . . . . ?
B1A B2A N2A C7A 169(3) . . . . ?
C11A B2A N2A C6A -178(3) . . . . ?
B1A B2A N2A C6A -5(4) . . . . ?
N2A B2A C11A C12A -47(3) . . . . ?
B1A B2A C11A C12A 139.8(13) . . . . ?
N2A B2A C11A C15A 148(3) . . . . ?
B1A B2A C11A C15A -25(2) . . . . ?
N2A B2A C11A W1 -133(3) . . . . ?
B1A B2A C11A W1 53.8(14) . . . . ?
C2 W1 C11A C12A -45.1(12) . . . . ?
C3 W1 C11A C12A 116.9(16) . . . . ?
C1A W1 C11A C12A -147(2) . . . . ?
C14A W1 C11A C12A 77.6(9) . . . . ?
C15A W1 C11A C12A 113.8(11) . . . . ?
C13A W1 C11A C12A 36.0(8) . . . . ?
C2 W1 C11A C15A -158.9(11) . . . . ?
C3 W1 C11A C15A 3.1(14) . . . . ?
C1B W1 C11A C15A 99.7(15) . . . . ?
C1A W1 C11A C15A 99.4(16) . . . . ?
C14A W1 C11A C15A -36.2(8) . . . . ?
C13A W1 C11A C15A -77.9(11) . . . . ?
C12A W1 C11A C15A -113.8(11) . . . . ?
C2 W1 C11A B2A 83.1(11) . . . . ?
C3 W1 C11A B2A -114.9(14) . . . . ?
C1A W1 C11A B2A -19(2) . . . . ?
C14A W1 C11A B2A -154.2(9) . . . . ?
C15A W1 C11A B2A -118.0(10) . . . . ?
C13A W1 C11A B2A 164.2(9) . . . . ?
C12A W1 C11A B2A 128.2(11) . . . . ?
C15A C11A C12A C13A 0.6(11) . . . . ?
B2A C11A C12A C13A -165.9(14) . . . . ?
W1 C11A C12A C13A -60.8(17) . . . . ?
C15A C11A C12A W1 61.5(15) . . . . ?
B2A C11A C12A W1 -105.1(15) . . . . ?
C2 W1 C12A C13A -100.7(13) . . . . ?
C3 W1 C12A C13A -6.2(17) . . . . ?
C1A W1 C12A C13A 155(3) . . . . ?
C14A W1 C12A C13A 37.9(7) . . . . ?
C15A W1 C12A C13A 79.8(11) . . . . ?
C2 W1 C12A C11A 140.4(10) . . . . ?
C3 W1 C12A C11A -125.1(13) . . . . ?
C1A W1 C12A C11A 37(2) . . . . ?
C14A W1 C12A C11A -81.0(9) . . . . ?
C15A W1 C12A C11A -39.1(6) . . . . ?
C13A W1 C12A C11A -118.9(12) . . . . ?
C11A C12A C13A C14A -0.4(13) . . . . ?
W1 C12A C13A C14A -63.2(14) . . . . ?
C11A C12A C13A W1 62.8(14) . . . . ?
C2 W1 C13A C14A -163.0(12) . . . . ?
C3 W1 C13A C14A -67.9(11) . . . . ?
C1A W1 C13A C14A 76(5) . . . . ?
C15A W1 C13A C14A 38.4(8) . . . . ?
C12A W1 C13A C14A 115.8(10) . . . . ?
C2 W1 C13A C12A 81.3(11) . . . . ?
C3 W1 C13A C12A 176.4(10) . . . . ?
C1A W1 C13A C12A -40(5) . . . . ?
C14A W1 C13A C12A -115.8(10) . . . . ?
C15A W1 C13A C12A -77.4(8) . . . . ?
C12A C13A C14A C15A -0.1(12) . . . . ?
W1 C13A C14A C15A -66.3(10) . . . . ?
C12A C13A C14A W1 66.2(11) . . . . ?
C2 W1 C14A C15A 136.4(11) . . . . ?
C3 W1 C14A C15A -125.3(7) . . . . ?
C1A W1 C14A C15A -22(2) . . . . ?
C13A W1 C14A C15A 114.1(11) . . . . ?
C12A W1 C14A C15A 76.8(7) . . . . ?
C2 W1 C14A C13A 22.3(15) . . . . ?
C3 W1 C14A C13A 120.6(11) . . . . ?
C1A W1 C14A C13A -136(3) . . . . ?
C15A W1 C14A C13A -114.1(11) . . . . ?
C12A W1 C14A C13A -37.3(8) . . . . ?
C13A C14A C15A C11A 0.5(12) . . . . ?
W1 C14A C15A C11A -66.1(14) . . . . ?
C13A C14A C15A W1 66.7(14) . . . . ?
C12A C11A C15A C14A -0.7(11) . . . . ?
B2A C11A C15A C14A 167.3(12) . . . . ?
W1 C11A C15A C14A 63.3(10) . . . . ?
C12A C11A C15A W1 -64.0(10) . . . . ?
B2A C11A C15A W1 104.0(14) . . . . ?
C2 W1 C15A C14A -81.2(18) . . . . ?
C3 W1 C15A C14A 63.4(9) . . . . ?
C1A W1 C15A C14A 162.2(19) . . . . ?
C13A W1 C15A C14A -38.7(8) . . . . ?
C12A W1 C15A C14A -80.3(8) . . . . ?
C2 W1 C15A C11A 37.1(17) . . . . ?
C3 W1 C15A C11A -178.3(8) . . . . ?
C1A W1 C15A C11A -79.5(15) . . . . ?
C14A W1 C15A C11A 118.3(10) . . . . ?
C13A W1 C15A C11A 79.6(10) . . . . ?
C12A W1 C15A C11A 38.0(7) . . . . ?
C2 W1 C1B O1B -132(3) . . . . ?
C3 W1 C1B O1B 133(3) . . . . ?
C12B W1 C1B O1B -30(3) . . . . ?
C11B W1 C1B O1B -13(3) . . . . ?
C13B W1 C1B O1B 2(4) . . . . ?
C15B W1 C1B O1B 22(3) . . . . ?
C12A W1 C1B O1B -37(4) . . . . ?
C2 W1 C1B Pt1 45.9(8) . . . . ?
C3 W1 C1B Pt1 -49.3(8) . . . . ?
C12B W1 C1B Pt1 147.6(6) . . . . ?
C11B W1 C1B Pt1 164.8(8) . . . . ?
C13B W1 C1B Pt1 -179.7(8) . . . . ?
C15B W1 C1B Pt1 -160.0(8) . . . . ?
W1 C1B O1B B1B 18(4) . . . . ?
Pt1 C1B O1B B1B -159.0(12) . . . . ?
C1B O1B B1B N1B -161.0(19) . . . . ?
C1B O1B B1B B2B 17(2) . . . . ?
O1B B1B N1B C4B 2(2) . . . . ?
B2B B1B N1B C4B -175.9(14) . . . . ?
O1B B1B N1B C5B 178.3(15) . . . . ?
B2B B1B N1B C5B 0(2) . . . . ?
N1B B1B B2B N2B -63.6(17) . . . . ?
O1B B1B B2B N2B 118.5(15) . . . . ?
N1B B1B B2B C11B 120.5(14) . . . . ?
O1B B1B B2B C11B -57.4(11) . . . . ?
C11B B2B N2B C7B -9.4(18) . . . . ?
B1B B2B N2B C7B 175.0(11) . . . . ?
C11B B2B N2B C6B 176.1(11) . . . . ?
B1B B2B N2B C6B 0.4(18) . . . . ?
N2B B2B C11B C12B -36.9(17) . . . . ?
B1B B2B C11B C12B 139.1(10) . . . . ?
N2B B2B C11B C15B 157.9(13) . . . . ?
B1B B2B C11B C15B -26.1(12) . . . . ?
N2B B2B C11B W1 -119.3(11) . . . . ?
B1B B2B C11B W1 56.7(9) . . . . ?
C2 W1 C11B C12B -48.8(8) . . . . ?
C3 W1 C11B C12B 101.5(9) . . . . ?
C1B W1 C11B C12B -153.3(10) . . . . ?
C13B W1 C11B C12B 37.0(7) . . . . ?
C15B W1 C11B C12B 112.1(9) . . . . ?
C2 W1 C11B C15B -160.9(6) . . . . ?
C3 W1 C11B C15B -10.7(9) . . . . ?
C1B W1 C11B C15B 94.6(8) . . . . ?
C12B W1 C11B C15B -112.1(9) . . . . ?
C13B W1 C11B C15B -75.1(6) . . . . ?
C2 W1 C11B B2B 79.4(8) . . . . ?
C3 W1 C11B B2B -130.3(8) . . . . ?
C1B W1 C11B B2B -25.1(10) . . . . ?
C1A W1 C11B B2B -26(2) . . . . ?
C12B W1 C11B B2B 128.2(10) . . . . ?
C13B W1 C11B B2B 165.2(8) . . . . ?
C15B W1 C11B B2B -119.6(9) . . . . ?
C15B C11B C12B C13B 0.6(10) . . . . ?
B2B C11B C12B C13B -166.6(10) . . . . ?
W1 C11B C12B C13B -65.5(8) . . . . ?
C15B C11B C12B W1 66.1(7) . . . . ?
B2B C11B C12B W1 -101.1(10) . . . . ?
C2 W1 C12B C13B -104.6(7) . . . . ?
C3 W1 C12B C13B -7.6(9) . . . . ?
C1B W1 C12B C13B 147.5(11) . . . . ?
C11B W1 C12B C13B 116.7(9) . . . . ?
C15B W1 C12B C13B 77.2(7) . . . . ?
C2 W1 C12B C11B 138.6(7) . . . . ?
C3 W1 C12B C11B -124.4(7) . . . . ?
C1B W1 C12B C11B 30.7(10) . . . . ?
C13B W1 C12B C11B -116.7(9) . . . . ?
C15B W1 C12B C11B -39.5(6) . . . . ?
C11B C12B C13B C14B -0.3(12) . . . . ?
W1 C12B C13B C14B -65.8(8) . . . . ?
C11B C12B C13B W1 65.5(7) . . . . ?
C2 W1 C13B C14B -164.4(7) . . . . ?
C3 W1 C13B C14B -69.5(8) . . . . ?
C1B W1 C13B C14B 60.6(18) . . . . ?
C12B W1 C13B C14B 115.8(10) . . . . ?
C11B W1 C13B C14B 78.7(7) . . . . ?
C15B W1 C13B C14B 36.7(6) . . . . ?
C2 W1 C13B C12B 79.9(7) . . . . ?
C3 W1 C13B C12B 174.7(6) . . . . ?
C1B W1 C13B C12B -55.2(17) . . . . ?
C11B W1 C13B C12B -37.1(6) . . . . ?
C15B W1 C13B C12B -79.0(7) . . . . ?
C12B C13B C14B C15B -0.1(11) . . . . ?
W1 C13B C14B C15B -63.6(7) . . . . ?
C12B C13B C14B W1 63.5(7) . . . . ?
C2 W1 C14B C15B 137.5(6) . . . . ?
C3 W1 C14B C15B -130.3(6) . . . . ?
C1B W1 C14B C15B -28.2(9) . . . . ?
C12B W1 C14B C15B 78.1(7) . . . . ?
C11B W1 C14B C15B 36.2(6) . . . . ?
C13B W1 C14B C15B 116.0(10) . . . . ?
C2 W1 C14B C13B 21.5(10) . . . . ?
C3 W1 C14B C13B 113.7(8) . . . . ?
C1B W1 C14B C13B -144.2(10) . . . . ?
C12B W1 C14B C13B -37.9(7) . . . . ?
C11B W1 C14B C13B -79.7(8) . . . . ?
C15B W1 C14B C13B -116.0(10) . . . . ?
C13B C14B C15B C11B 0.5(11) . . . . ?
W1 C14B C15B C11B -62.4(7) . . . . ?
C13B C14B C15B W1 62.9(8) . . . . ?
C12B C11B C15B C14B -0.7(10) . . . . ?
B2B C11B C15B C14B 167.9(8) . . . . ?
W1 C11B C15B C14B 63.9(7) . . . . ?
C12B C11B C15B W1 -64.6(6) . . . . ?
B2B C11B C15B W1 104.0(8) . . . . ?
C2 W1 C15B C14B -83.5(10) . . . . ?
C3 W1 C15B C14B 54.3(7) . . . . ?
C1B W1 C15B C14B 156.1(9) . . . . ?
C12B W1 C15B C14B -79.7(7) . . . . ?
C11B W1 C15B C14B -119.2(8) . . . . ?
C13B W1 C15B C14B -37.4(7) . . . . ?
C2 W1 C15B C11B 35.8(11) . . . . ?
C3 W1 C15B C11B 173.5(6) . . . . ?
C1B W1 C15B C11B -84.7(8) . . . . ?
C12B W1 C15B C11B 39.5(6) . . . . ?
C13B W1 C15B C11B 81.9(7) . . . . ?
O1A C1A Pt1 P1 7(7) . . . . ?
W1 C1A Pt1 P1 -178.9(18) . . . . ?
O1A C1A Pt1 P2 -178(3) . . . . ?
W1 C1A Pt1 P2 -4(9) . . . . ?
O1A C1A Pt1 W1 -174(8) . . . . ?
O1B C1B Pt1 P1 -2(2) . . . . ?
W1 C1B Pt1 P1 179.6(6) . . . . ?
O1B C1B Pt1 P2 167.8(10) . . . . ?
W1 C1B Pt1 P2 -11(3) . . . . ?
O1B C1B Pt1 W1 178(3) . . . . ?
C2 W1 Pt1 C1A -135(3) . . . . ?
C3 W1 Pt1 C1A 126(3) . . . . ?
C14A W1 Pt1 C1A 67(4) . . . . ?
C15A W1 Pt1 C1A 19(3) . . . . ?
C13A W1 Pt1 C1A -127(5) . . . . ?
C12A W1 Pt1 C1A -68(3) . . . . ?
C2 W1 Pt1 C1B -132.8(10) . . . . ?
C3 W1 Pt1 C1B 127.9(10) . . . . ?
C12B W1 Pt1 C1B -69.9(13) . . . . ?
C11B W1 Pt1 C1B -20.4(11) . . . . ?
C13B W1 Pt1 C1B 179(2) . . . . ?
C15B W1 Pt1 C1B 27.9(11) . . . . ?
C2 W1 Pt1 P1 -133.4(3) . . . . ?
C3 W1 Pt1 P1 127.3(3) . . . . ?
C1B W1 Pt1 P1 -0.6(10) . . . . ?
C1A W1 Pt1 P1 2(3) . . . . ?
C14A W1 Pt1 P1 68(2) . . . . ?
C15A W1 Pt1 P1 20.7(9) . . . . ?
C13A W1 Pt1 P1 -125(4) . . . . ?
C12B W1 Pt1 P1 -70.6(7) . . . . ?
C11B W1 Pt1 P1 -21.0(4) . . . . ?
C13B W1 Pt1 P1 179(2) . . . . ?
C15B W1 Pt1 P1 27.3(4) . . . . ?
C12A W1 Pt1 P1 -66.6(11) . . . . ?
C2 W1 Pt1 P2 43.6(3) . . . . ?
C3 W1 Pt1 P2 -55.7(3) . . . . ?
C1B W1 Pt1 P2 176.4(10) . . . . ?
C1A W1 Pt1 P2 179(3) . . . . ?
C14A W1 Pt1 P2 -115(2) . . . . ?
C15A W1 Pt1 P2 -162.3(9) . . . . ?
C13A W1 Pt1 P2 52(4) . . . . ?
C12B W1 Pt1 P2 106.5(7) . . . . ?
C11B W1 Pt1 P2 156.0(4) . . . . ?
C13B W1 Pt1 P2 -4(2) . . . . ?
C15B W1 Pt1 P2 -155.7(4) . . . . ?
C12A W1 Pt1 P2 110.4(11) . . . . ?
C1A Pt1 P1 C41 174(2) . . . . ?
C1B Pt1 P1 C41 172.8(8) . . . . ?
P2 Pt1 P1 C41 -4.1(3) . . . . ?
W1 Pt1 P1 C41 173.2(3) . . . . ?
C1A Pt1 P1 C31 -64(2) . . . . ?
C1B Pt1 P1 C31 -65.6(7) . . . . ?
P2 Pt1 P1 C31 117.5(3) . . . . ?
W1 Pt1 P1 C31 -65.2(3) . . . . ?
C1A Pt1 P1 C21 53(2) . . . . ?
C1B Pt1 P1 C21 50.8(7) . . . . ?
P2 Pt1 P1 C21 -126.0(2) . . . . ?
W1 Pt1 P1 C21 51.3(3) . . . . ?
C1A Pt1 P2 C71 -131(7) . . . . ?
C1B Pt1 P2 C71 -126(2) . . . . ?
P1 Pt1 P2 C71 43.8(3) . . . . ?
W1 Pt1 P2 C71 -134.2(3) . . . . ?
C1A Pt1 P2 C61 108(7) . . . . ?
C1B Pt1 P2 C61 113(2) . . . . ?
P1 Pt1 P2 C61 -77.2(3) . . . . ?
W1 Pt1 P2 C61 104.8(3) . . . . ?
C1A Pt1 P2 C51 -12(7) . . . . ?
C1B Pt1 P2 C51 -7(2) . . . . ?
P1 Pt1 P2 C51 162.8(3) . . . . ?
W1 Pt1 P2 C51 -15.2(3) . . . . ?
C41 P1 C21 C22 -95.2(6) . . . . ?
C31 P1 C21 C22 161.2(6) . . . . ?
Pt1 P1 C21 C22 37.9(6) . . . . ?
C41 P1 C21 C26 86.5(6) . . . . ?
C31 P1 C21 C26 -17.1(7) . . . . ?
Pt1 P1 C21 C26 -140.4(5) . . . . ?
C26 C21 C22 C23 0.7(11) . . . . ?
P1 C21 C22 C23 -177.7(6) . . . . ?
C21 C22 C23 C24 0.1(12) . . . . ?
C22 C23 C24 C25 -0.6(12) . . . . ?
C23 C24 C25 C26 0.2(12) . . . . ?
C24 C25 C26 C21 0.6(11) . . . . ?
C22 C21 C26 C25 -1.1(11) . . . . ?
P1 C21 C26 C25 177.2(6) . . . . ?
C41 P1 C31 C32 151.8(7) . . . . ?
C21 P1 C31 C32 -101.7(7) . . . . ?
Pt1 P1 C31 C32 18.2(8) . . . . ?
C41 P1 C31 C36 -28.8(7) . . . . ?
C21 P1 C31 C36 77.7(7) . . . . ?
Pt1 P1 C31 C36 -162.4(6) . . . . ?
C36 C31 C32 C33 -3.5(13) . . . . ?
P1 C31 C32 C33 176.0(7) . . . . ?
C31 C32 C33 C34 3.1(15) . . . . ?
C32 C33 C34 C35 -0.5(16) . . . . ?
C33 C34 C35 C36 -1.7(15) . . . . ?
C34 C35 C36 C31 1.2(13) . . . . ?
C32 C31 C36 C35 1.3(12) . . . . ?
P1 C31 C36 C35 -178.1(6) . . . . ?
C31 P1 C41 C46 120.3(7) . . . . ?
C21 P1 C41 C46 13.6(7) . . . . ?
Pt1 P1 C41 C46 -111.3(6) . . . . ?
C31 P1 C41 C42 -58.0(6) . . . . ?
C21 P1 C41 C42 -164.8(6) . . . . ?
Pt1 P1 C41 C42 70.4(7) . . . . ?
C46 C41 C42 C43 -1.5(12) . . . . ?
P1 C41 C42 C43 177.0(6) . . . . ?
C41 C42 C43 C44 0.3(13) . . . . ?
C42 C43 C44 C45 -0.1(14) . . . . ?
C43 C44 C45 C46 1.1(14) . . . . ?
C42 C41 C46 C45 2.4(12) . . . . ?
P1 C41 C46 C45 -175.9(6) . . . . ?
C44 C45 C46 C41 -2.3(13) . . . . ?
C71 P2 C51 C56 17.0(7) . . . . ?
C61 P2 C51 C56 125.5(7) . . . . ?
Pt1 P2 C51 C56 -106.4(6) . . . . ?
C71 P2 C51 C52 -163.9(6) . . . . ?
C61 P2 C51 C52 -55.4(7) . . . . ?
Pt1 P2 C51 C52 72.7(7) . . . . ?
C56 C51 C52 C53 -1.2(12) . . . . ?
P2 C51 C52 C53 179.7(6) . . . . ?
C51 C52 C53 C54 0.7(13) . . . . ?
C52 C53 C54 C55 -0.1(12) . . . . ?
C53 C54 C55 C56 -0.1(12) . . . . ?
C52 C51 C56 C55 1.0(12) . . . . ?
P2 C51 C56 C55 -179.9(6) . . . . ?
C54 C55 C56 C51 -0.4(13) . . . . ?
C71 P2 C61 C66 -124.8(7) . . . . ?
C51 P2 C61 C66 130.2(7) . . . . ?
Pt1 P2 C61 C66 -1.2(7) . . . . ?
C71 P2 C61 C62 59.8(7) . . . . ?
C51 P2 C61 C62 -45.1(7) . . . . ?
Pt1 P2 C61 C62 -176.5(6) . . . . ?
C66 C61 C62 C63 1.8(13) . . . . ?
P2 C61 C62 C63 177.2(7) . . . . ?
C61 C62 C63 C64 -2.1(15) . . . . ?
C62 C63 C64 C65 1.4(16) . . . . ?
C63 C64 C65 C66 -0.5(16) . . . . ?
C62 C61 C66 C65 -0.9(12) . . . . ?
P2 C61 C66 C65 -176.4(7) . . . . ?
C64 C65 C66 C61 0.3(14) . . . . ?
C61 P2 C71 C72 3.5(7) . . . . ?
C51 P2 C71 C72 106.5(7) . . . . ?
Pt1 P2 C71 C72 -123.4(6) . . . . ?
C61 P2 C71 C76 179.4(6) . . . . ?
C51 P2 C71 C76 -77.6(6) . . . . ?
Pt1 P2 C71 C76 52.5(6) . . . . ?
C76 C71 C72 C73 0.6(11) . . . . ?
P2 C71 C72 C73 176.4(6) . . . . ?
C71 C72 C73 C74 2.9(12) . . . . ?
C72 C73 C74 C75 -3.1(13) . . . . ?
C73 C74 C75 C76 -0.2(12) . . . . ?
C74 C75 C76 C71 3.6(12) . . . . ?
C72 C71 C76 C75 -3.8(11) . . . . ?
P2 C71 C76 C75 -180.0(6) . . . . ?
