#------------------------------------------------------------------------------
#$Date: 2016-03-25 13:08:46 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179828 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/24/7012485.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_7012485
loop_
_publ_author_name
'Li, Qing-Shan'
'Xu, Feng-Bo'
'Cui, Da-Jun'
'Yu, Kai'
'Zeng, Xian-Shun'
'Leng, Xue-Bing'
'Song, Hai-Bin'
'Zhang, Zheng-Zhi'
_publ_section_title
;
 Heterobimetallic Pt(ii)--M(i) (M = Cu, Ag) eight-membered
 macrocyclic complexes with large-bite P,N-ligand bridgesElectronic
 supplementary information (ESI) available: UV-vis absorption spectra
 and the fluorescence excitation and emission spectra of complexes 3
 and 5. See http://www.rsc.org/suppdata/dt/b2/b211301p/
;
_journal_issue                   8
_journal_name_full               'Dalton Transactions'
_journal_page_first              1551
_journal_paper_doi               10.1039/b211301p
_journal_year                    2003
_chemical_formula_sum            'C66 H56 N4 P2 Pt'
_chemical_formula_weight         1162.18
_chemical_name_systematic
; 
? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 95.618(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   9.3607(9)
_cell_length_b                   10.6329(10)
_cell_length_c                   27.735(3)
_cell_measurement_temperature    293(2)
_cell_volume                     2747.2(5)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.528
_diffrn_measured_fraction_theta_max 0.528
_diffrn_measurement_device_type  'CCD area 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  0.0369
_diffrn_reflns_av_sigmaI/netI    0.0452
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       7
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            5835
_diffrn_reflns_theta_full        25.39
_diffrn_reflns_theta_max         25.39
_diffrn_reflns_theta_min         1.48
_exptl_absorpt_coefficient_mu    2.657
_exptl_absorpt_correction_T_max  0.9739
_exptl_absorpt_correction_T_min  0.5029
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_density_diffrn    1.405
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1176
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.01
_refine_diff_density_max         1.206
_refine_diff_density_min         -0.847
_refine_diff_density_rms         0.121
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.149
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     359
_refine_ls_number_reflns         2664
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.149
_refine_ls_R_factor_all          0.0255
_refine_ls_R_factor_gt           0.0242
_refine_ls_shift/su_max          0.756
_refine_ls_shift/su_mean         0.004
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0418P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0555
_refine_ls_wR_factor_ref         0.0732
_reflns_number_gt                2654
_reflns_number_total             2664
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b211301p.txt
_cod_data_source_block           complex_3
_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.

'_exptl_absorpt_correction_type' value 'MULTI-SCAN' changed
to 'multi-scan' 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_H-M      P2(1)/c
_cod_database_code               7012485
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.0000 0.0000 0.0000 0.02786(14) Uani 1 2 d S . .
P1 P 0.08421(19) 0.14274(17) 0.05851(7) 0.0281(4) Uani 1 1 d . . .
N1 N 0.1895(9) 0.0297(7) 0.1455(3) 0.045(3) Uani 1 1 d . . .
N2 N 0.2741(12) 0.2206(10) 0.1760(3) 0.076(3) Uani 1 1 d . . .
C1 C 0.2735(8) 0.1794(7) 0.0589(3) 0.0325(16) Uani 1 1 d . . .
C2 C 0.3658(8) 0.0813(8) 0.0517(3) 0.043(2) Uani 1 1 d . . .
H2A H 0.3292 0.0015 0.0445 0.044(17) Uiso 1 1 d R . .
C3 C 0.5137(9) 0.1021(10) 0.0555(3) 0.052(2) Uani 1 1 d . . .
H3A H 0.5757 0.0352 0.0517 0.07(3) Uiso 1 1 d R . .
C4 C 0.5717(18) 0.2201(19) 0.0674(9) 0.060(5) Uani 1 1 d . . .
H4A H 0.6703 0.2334 0.0695 0.09(4) Uiso 1 1 d R . .
C5 C 0.4757(12) 0.3193(11) 0.0718(6) 0.070(3) Uani 1 1 d . . .
H5A H 0.5128 0.3996 0.0778 0.09(4) Uiso 1 1 d R . .
C6 C 0.3303(9) 0.2989(8) 0.0682(3) 0.048(2) Uani 1 1 d . . .
H6A H 0.2691 0.3659 0.0727 0.03(2) Uiso 1 1 d R . .
C7 C -0.0166(7) 0.2889(7) 0.0517(3) 0.0322(16) Uani 1 1 d . . .
C8 C -0.0207(10) 0.3758(9) 0.0892(3) 0.050(2) Uani 1 1 d . . .
H8A H 0.0321 0.3615 0.1189 0.10(4) Uiso 1 1 d R . .
C9 C -0.1040(10) 0.485(4) 0.0822(5) 0.063(7) Uani 1 1 d . . .
H9A H -0.1053 0.5425 0.1073 0.12(7) Uiso 1 1 d R . .
C10 C -0.1812(10) 0.508(10) 0.0388(4) 0.057(7) Uani 1 1 d . . .
H10A H -0.2376 0.5797 0.0346 0.07(3) Uiso 1 1 d R . .
C11 C -0.1772(10) 0.4213(9) 0.0019(4) 0.058(3) Uani 1 1 d . . .
H11A H -0.2298 0.4367 -0.0277 0.04(2) Uiso 1 1 d R . .
C12 C -0.0969(9) 0.3129(8) 0.0078(3) 0.0424(19) Uani 1 1 d . . .
H12A H -0.0946 0.2566 -0.0178 0.13(6) Uiso 1 1 d R . .
C13 C 0.0666(8) 0.0956(8) 0.1232(3) 0.0378(18) Uani 1 1 d . . .
H13A H 0.0496 0.1703 0.1418 0.10(4) Uiso 1 1 d R . .
H13B H -0.0166 0.0415 0.1237 0.04(2) Uiso 1 1 d R . .
C14 C 0.3006(11) 0.0990(13) 0.1701(4) 0.066(3) Uani 1 1 d . . .
C15 C 0.4294(15) 0.037(6) 0.1875(5) 0.12(3) Uani 1 1 d . . .
H15A H 0.4432 -0.0494 0.1844 0.04(6) Uiso 1 1 d R . .
C16 C 0.534(2) 0.120(3) 0.2087(7) 0.155(11) Uani 1 1 d . . .
H16A H 0.6222 0.0854 0.2201 0.22(10) Uiso 1 1 d R . .
C17 C 0.511(3) 0.243(3) 0.2143(7) 0.164(14) Uani 1 1 d . . .
H17A H 0.5833 0.2952 0.2286 0.16(7) Uiso 1 1 d R . .
C18 C 0.381(2) 0.2900(19) 0.1980(5) 0.118(7) Uani 1 1 d . . .
H18A H 0.3649 0.3755 0.2024 0.11(6) Uiso 1 1 d R . .
C19 C 0.1990(13) -0.1018(11) 0.1371(4) 0.054(3) Uani 1 1 d . . .
H19A H 0.2969 -0.1214 0.1311 0.06(3) Uiso 1 1 d R . .
H19B H 0.1377 -0.1222 0.1079 0.04(3) Uiso 1 1 d R . .
C20 C 0.1585(10) -0.1875(9) 0.1776(3) 0.049(2) Uani 1 1 d . . .
C21 C 0.1317(11) -0.1405(11) 0.2218(4) 0.062(3) Uani 1 1 d . . .
H21A H 0.1417 -0.0548 0.2279 0.09(4) Uiso 1 1 d R . .
C22 C 0.0919(14) -0.2201(14) 0.2577(5) 0.083(4) Uani 1 1 d . . .
H22A H 0.0738 -0.1871 0.2876 0.10(4) Uiso 1 1 d R . .
C23 C 0.0776(14) -0.3456(14) 0.2493(5) 0.085(4) Uani 1 1 d . . .
H23A H 0.0500 -0.3988 0.2733 0.13(5) Uiso 1 1 d R . .
C24 C 0.1035(13) -0.3932(12) 0.2058(5) 0.080(4) Uani 1 1 d . . .
H24A H 0.0955 -0.4792 0.2001 0.11(4) Uiso 1 1 d R . .
C25 C 0.1444(11) -0.3145(10) 0.1702(4) 0.065(3) Uani 1 1 d . . .
H25A H 0.1620 -0.3478 0.1403 0.06(3) Uiso 1 1 d R . .
C26 C -0.1212(8) -0.0873(7) 0.0460(3) 0.0347(17) Uani 1 1 d . . .
C27 C -0.1931(8) -0.1390(8) 0.0723(3) 0.0371(17) Uani 1 1 d . . .
C28 C -0.2864(8) -0.2063(7) 0.1023(3) 0.0377(18) Uani 1 1 d . . .
C29 C -0.421(3) -0.258(2) 0.0820(8) 0.065(6) Uani 1 1 d . . .
H29A H -0.4514 -0.2434 0.0496 0.00(2) Uiso 1 1 d R . .
C30 C -0.5020(12) -0.3241(12) 0.1120(5) 0.070(3) Uani 1 1 d . . .
H30A H -0.5897 -0.3553 0.0984 0.09(4) Uiso 1 1 d R . .
C31 C -0.4595(13) -0.3453(12) 0.1585(5) 0.079(4) Uani 1 1 d . . .
H31A H -0.5174 -0.3923 0.1772 0.11(5) Uiso 1 1 d R . .
C32 C -0.3312(12) -0.2992(13) 0.1792(4) 0.078(4) Uani 1 1 d . . .
H32A H -0.3021 -0.3148 0.2116 0.11(5) Uiso 1 1 d R . .
C33 C -0.2454(10) -0.2299(11) 0.1510(3) 0.057(2) Uani 1 1 d . . .
H33A H -0.1591 -0.1976 0.1653 0.06(3) Uiso 1 1 d 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'
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'
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
C26 Pt1 C26 180.0(5) . 3 ?
C26 Pt1 P1 91.9(2) . . ?
C26 Pt1 P1 88.1(2) 3 . ?
C26 Pt1 P1 88.1(2) . 3 ?
C26 Pt1 P1 91.9(2) 3 3 ?
P1 Pt1 P1 180.00(10) . 3 ?
C1 P1 C7 108.3(3) . . ?
C1 P1 C13 103.2(3) . . ?
C7 P1 C13 103.5(4) . . ?
C1 P1 Pt1 114.4(3) . . ?
C7 P1 Pt1 110.6(3) . . ?
C13 P1 Pt1 116.0(3) . . ?
C14 N1 C19 122.9(10) . . ?
C14 N1 C13 118.7(8) . . ?
C19 N1 C13 118.0(10) . . ?
C14 N2 C18 116.9(14) . . ?
C2 C1 C6 118.9(7) . . ?
C2 C1 P1 117.5(6) . . ?
C6 C1 P1 123.6(6) . . ?
C1 C2 C3 120.0(8) . . ?
C1 C2 H2A 119.9 . . ?
C3 C2 H2A 120.2 . . ?
C4 C3 C2 121.4(10) . . ?
C4 C3 H3A 118.8 . . ?
C2 C3 H3A 119.7 . . ?
C3 C4 C5 117.5(13) . . ?
C3 C4 H4A 120.9 . . ?
C5 C4 H4A 121.4 . . ?
C6 C5 C4 121.0(11) . . ?
C6 C5 H5A 120.5 . . ?
C4 C5 H5A 118.4 . . ?
C5 C6 C1 121.0(9) . . ?
C5 C6 H6A 119.3 . . ?
C1 C6 H6A 119.7 . . ?
C12 C7 C8 118.7(7) . . ?
C12 C7 P1 118.6(6) . . ?
C8 C7 P1 122.7(6) . . ?
C7 C8 C9 120.0(10) . . ?
C7 C8 H8A 120.1 . . ?
C9 C8 H8A 119.9 . . ?
C10 C9 C8 121(4) . . ?
C10 C9 H9A 119.7 . . ?
C8 C9 H9A 119.5 . . ?
C9 C10 C11 119(7) . . ?
C9 C10 H10A 120.4 . . ?
C11 C10 H10A 120.7 . . ?
C12 C11 C10 122(3) . . ?
C12 C11 H11A 119.2 . . ?
C10 C11 H11A 119.2 . . ?
C11 C12 C7 120.0(8) . . ?
C11 C12 H12A 120.1 . . ?
C7 C12 H12A 119.9 . . ?
N1 C13 P1 113.5(6) . . ?
N1 C13 H13A 109.7 . . ?
P1 C13 H13A 108.9 . . ?
N1 C13 H13B 108.4 . . ?
P1 C13 H13B 108.5 . . ?
H13A C13 H13B 107.7 . . ?
N2 C14 N1 115.7(10) . . ?
N2 C14 C15 125(2) . . ?
N1 C14 C15 119(2) . . ?
C16 C15 C14 112(4) . . ?
C16 C15 H15A 124.1 . . ?
C14 C15 H15A 123.4 . . ?
C17 C16 C15 124(3) . . ?
C17 C16 H16A 119.5 . . ?
C15 C16 H16A 116.8 . . ?
C16 C17 C18 117.9(19) . . ?
C16 C17 H17A 121.0 . . ?
C18 C17 H17A 121.1 . . ?
N2 C18 C17 124(2) . . ?
N2 C18 H18A 118.6 . . ?
C17 C18 H18A 117.6 . . ?
N1 C19 C20 116.3(10) . . ?
N1 C19 H19A 108.3 . . ?
C20 C19 H19A 107.8 . . ?
N1 C19 H19B 108.4 . . ?
C20 C19 H19B 108.2 . . ?
H19A C19 H19B 107.5 . . ?
C25 C20 C21 118.1(10) . . ?
C25 C20 C19 120.4(10) . . ?
C21 C20 C19 121.5(10) . . ?
C20 C21 C22 120.4(11) . . ?
C20 C21 H21A 119.7 . . ?
C22 C21 H21A 119.9 . . ?
C23 C22 C21 120.4(12) . . ?
C23 C22 H22A 120.0 . . ?
C21 C22 H22A 119.6 . . ?
C24 C23 C22 119.9(11) . . ?
C24 C23 H23A 119.8 . . ?
C22 C23 H23A 120.3 . . ?
C23 C24 C25 119.9(12) . . ?
C23 C24 H24A 120.1 . . ?
C25 C24 H24A 120.0 . . ?
C20 C25 C24 121.4(12) . . ?
C20 C25 H25A 119.1 . . ?
C24 C25 H25A 119.5 . . ?
C27 C26 Pt1 179.0(7) . . ?
C26 C27 C28 176.7(9) . . ?
C33 C28 C29 117.5(10) . . ?
C33 C28 C27 121.4(8) . . ?
C29 C28 C27 121.0(10) . . ?
C30 C29 C28 118.2(17) . . ?
C30 C29 H29A 122.0 . . ?
C28 C29 H29A 119.7 . . ?
C31 C30 C29 122.8(15) . . ?
C31 C30 H30A 120.0 . . ?
C29 C30 H30A 117.2 . . ?
C30 C31 C32 120.7(10) . . ?
C30 C31 H31A 119.7 . . ?
C32 C31 H31A 119.6 . . ?
C31 C32 C33 119.2(11) . . ?
C31 C32 H32A 120.1 . . ?
C33 C32 H32A 120.7 . . ?
C32 C33 C28 121.5(10) . . ?
C32 C33 H33A 118.7 . . ?
C28 C33 H33A 119.7 . . ?
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 C26 2.015(8) . ?
Pt1 C26 2.015(8) 3 ?
Pt1 P1 2.3039(19) . ?
Pt1 P1 2.3039(19) 3 ?
P1 C1 1.813(7) . ?
P1 C7 1.819(8) . ?
P1 C13 1.885(7) . ?
N1 C14 1.397(14) . ?
N1 C19 1.422(16) . ?
N1 C13 1.435(12) . ?
N2 C14 1.329(16) . ?
N2 C18 1.339(15) . ?
C1 C2 1.382(11) . ?
C1 C6 1.392(11) . ?
C2 C3 1.396(12) . ?
C2 H2A 0.9298 . ?
C3 C4 1.39(2) . ?
C3 H3A 0.9307 . ?
C4 C5 1.40(2) . ?
C4 H4A 0.9299 . ?
C5 C6 1.373(13) . ?
C5 H5A 0.9305 . ?
C6 H6A 0.9298 . ?
C7 C12 1.390(11) . ?
C7 C8 1.395(11) . ?
C8 C9 1.40(4) . ?
C8 H8A 0.9302 . ?
C9 C10 1.36(3) . ?
C9 H9A 0.9295 . ?
C10 C11 1.38(7) . ?
C10 H10A 0.9300 . ?
C11 C12 1.377(12) . ?
C11 H11A 0.9298 . ?
C12 H12A 0.9301 . ?
C13 H13A 0.9693 . ?
C13 H13B 0.9695 . ?
C14 C15 1.42(3) . ?
C15 C16 1.41(5) . ?
C15 H15A 0.9299 . ?
C16 C17 1.34(4) . ?
C16 H16A 0.9305 . ?
C17 C18 1.36(3) . ?
C17 H17A 0.9300 . ?
C18 H18A 0.9309 . ?
C19 C20 1.523(14) . ?
C19 H19A 0.9698 . ?
C19 H19B 0.9697 . ?
C20 C25 1.370(15) . ?
C20 C21 1.371(14) . ?
C21 C22 1.384(15) . ?
C21 H21A 0.9299 . ?
C22 C23 1.359(19) . ?
C22 H22A 0.9311 . ?
C23 C24 1.352(18) . ?
C23 H23A 0.9292 . ?
C24 C25 1.378(16) . ?
C24 H24A 0.9298 . ?
C25 H25A 0.9301 . ?
C26 C27 1.176(10) . ?
C27 C28 1.454(10) . ?
C28 C33 1.389(13) . ?
C28 C29 1.43(3) . ?
C29 C30 1.38(2) . ?
C29 H29A 0.9290 . ?
C30 C31 1.333(18) . ?
C30 H30A 0.9304 . ?
C31 C32 1.369(18) . ?
C31 H31A 0.9314 . ?
C32 C33 1.386(13) . ?
C32 H32A 0.9304 . ?
C33 H33A 0.9309 . ?
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
C26 Pt1 P1 C1 139.5(3) . . . . ?
C26 Pt1 P1 C1 -40.5(3) 3 . . . ?
P1 Pt1 P1 C1 174(13) 3 . . . ?
C26 Pt1 P1 C7 -97.9(3) . . . . ?
C26 Pt1 P1 C7 82.1(3) 3 . . . ?
P1 Pt1 P1 C7 -64(12) 3 . . . ?
C26 Pt1 P1 C13 19.5(4) . . . . ?
C26 Pt1 P1 C13 -160.5(4) 3 . . . ?
P1 Pt1 P1 C13 54(15) 3 . . . ?
C7 P1 C1 C2 -164.4(6) . . . . ?
C13 P1 C1 C2 86.3(7) . . . . ?
Pt1 P1 C1 C2 -40.6(7) . . . . ?
C7 P1 C1 C6 18.8(8) . . . . ?
C13 P1 C1 C6 -90.5(8) . . . . ?
Pt1 P1 C1 C6 142.5(7) . . . . ?
C6 C1 C2 C3 2.1(12) . . . . ?
P1 C1 C2 C3 -174.9(7) . . . . ?
C1 C2 C3 C4 1.3(17) . . . . ?
C2 C3 C4 C5 -5(3) . . . . ?
C3 C4 C5 C6 5(3) . . . . ?
C4 C5 C6 C1 -1(2) . . . . ?
C2 C1 C6 C5 -2.0(14) . . . . ?
P1 C1 C6 C5 174.8(9) . . . . ?
C1 P1 C7 C12 108.1(6) . . . . ?
C13 P1 C7 C12 -142.8(6) . . . . ?
Pt1 P1 C7 C12 -17.9(7) . . . . ?
C1 P1 C7 C8 -74.2(7) . . . . ?
C13 P1 C7 C8 34.9(7) . . . . ?
Pt1 P1 C7 C8 159.8(6) . . . . ?
C12 C7 C8 C9 -0.2(16) . . . . ?
P1 C7 C8 C9 -177.9(12) . . . . ?
C7 C8 C9 C10 0(4) . . . . ?
C8 C9 C10 C11 1(5) . . . . ?
C9 C10 C11 C12 0(5) . . . . ?
C10 C11 C12 C7 0(3) . . . . ?
C8 C7 C12 C11 0.6(12) . . . . ?
P1 C7 C12 C11 178.4(7) . . . . ?
C14 N1 C13 P1 90.1(9) . . . . ?
C19 N1 C13 P1 -83.3(11) . . . . ?
C1 P1 C13 N1 -35.1(7) . . . . ?
C7 P1 C13 N1 -147.9(6) . . . . ?
Pt1 P1 C13 N1 90.8(6) . . . . ?
C18 N2 C14 N1 -177.9(10) . . . . ?
C18 N2 C14 C15 4(2) . . . . ?
C19 N1 C14 N2 -178.5(11) . . . . ?
C13 N1 C14 N2 8.4(14) . . . . ?
C19 N1 C14 C15 0.2(19) . . . . ?
C13 N1 C14 C15 -172.9(13) . . . . ?
N2 C14 C15 C16 -5(2) . . . . ?
N1 C14 C15 C16 176.3(13) . . . . ?
C14 C15 C16 C17 4(3) . . . . ?
C15 C16 C17 C18 -1(4) . . . . ?
C14 N2 C18 C17 0(2) . . . . ?
C16 C17 C18 N2 -1(3) . . . . ?
C14 N1 C19 C20 85.6(14) . . . . ?
C13 N1 C19 C20 -101.3(12) . . . . ?
N1 C19 C20 C25 170.6(10) . . . . ?
N1 C19 C20 C21 -7.8(16) . . . . ?
C25 C20 C21 C22 0.1(16) . . . . ?
C19 C20 C21 C22 178.5(11) . . . . ?
C20 C21 C22 C23 -1(2) . . . . ?
C21 C22 C23 C24 1(2) . . . . ?
C22 C23 C24 C25 0(2) . . . . ?
C21 C20 C25 C24 0.5(16) . . . . ?
C19 C20 C25 C24 -178.0(10) . . . . ?
C23 C24 C25 C20 -0.6(18) . . . . ?
C26 Pt1 C26 C27 10(89) 3 . . . ?
P1 Pt1 C26 C27 161(41) . . . . ?
P1 Pt1 C26 C27 -19(41) 3 . . . ?
Pt1 C26 C27 C28 4(53) . . . . ?
C26 C27 C28 C33 157(14) . . . . ?
C26 C27 C28 C29 -19(15) . . . . ?
C33 C28 C29 C30 1(2) . . . . ?
C27 C28 C29 C30 177.8(13) . . . . ?
C28 C29 C30 C31 -2(3) . . . . ?
C29 C30 C31 C32 1(2) . . . . ?
C30 C31 C32 C33 0(2) . . . . ?
C31 C32 C33 C28 -0.1(18) . . . . ?
C29 C28 C33 C32 -0.6(18) . . . . ?
C27 C28 C33 C32 -177.0(10) . . . . ?
