##############################################################################
###                                                                        ###
###        Electronic paper (Acta Crystallographica Section E)             ###
###                                                                        ###
##############################################################################
#                                                                            #
# This CIF contains the data in a paper accepted for publication in Acta     #
# Crystallographica Section E. It conforms to the requirements of Notes      #
# for Authors for Section E, and has been peer reviewed under the auspices   #
# of the IUCr Commission on Journals.                                        #
#                                                                            #
# Full details of the Crystallographic Information File format               #
# are given in the paper "The Crystallographic Information File (CIF):       #
# a New Standard Archive File for Crystallography" by S. R. Hall, F. H.      #
# Allen and I. D. Brown [Acta Cryst. (1991), A47, 655-685].                  #
#                                                                            #
# The current version of the core CIF dictionary is obtainable from          #
# ftp://ftp.iucr.org/pub/cif_core.dic. The current version number is 2.1.    #
#                                                                            #
# Software is freely available for graphical display of the structure(s) in  #
# this CIF.  For information consult the CIF home page http://www.iucr.org/  #
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##############################################################################
                                             
data_global
_audit_creation_method
                  'from SHELXL97 and KenX, based on form.cif supplied from IUCr'
_journal_date_recd_electronic     2003-05-28
_journal_date_accepted     2003-06-19
_journal_name_full     'Acta Crystallographica, Section E'
_journal_year     2003
_journal_volume     59
_journal_issue      7
_journal_page_first     m512
_journal_page_last     m514
_journal_paper_category     EM
_publ_contact_author_name     'Dr Ken Sakai'
_publ_contact_author_address
;
    Department of Applied Chemistry
    Faculty of Science
    Tokyo University of Science
    Kagurazaka 1-3, Shinjuku-ku
    Tokyo 162-8601, Japan
;
_publ_contact_author_email     ksakai@rs.kagu.tus.ac.jp
_publ_contact_author_fax     '81 3 3260 4670'
_publ_contact_author_phone     '81 3 3260 4670'
_publ_section_title
;
(2,2'-Bipyridine)bis(N-methyl-4,4'-bipyridinium)platinum(II)
tetraperchlorate
;
loop_
    _publ_author_name
    _publ_author_address
    'Sakai, Ken'
;
    Department of Applied Chemistry
    Faculty of Science
    Tokyo University of Science
    Kagurazaka 1-3, Shinjuku-ku
    Tokyo 162-8601, Japan
;
    'Osada, Manabu'
;
    Department of Applied Chemistry
    Faculty of Science
    Tokyo University of Science
    Kagurazaka 1-3, Shinjuku-ku
    Tokyo 162-8601, Japan
;
    'Yokoyama, Yoshimi'
;
    Department of Applied Chemistry
    Faculty of Science
    Tokyo University of Science
    Kagurazaka 1-3, Shinjuku-ku
    Tokyo 162-8601, Japan
;
    'Tomita, Yasushi'
;
    Department of Applied Chemistry
    Faculty of Engineering
    Seikei University
    Kichijoji-Kitamachi 3-3-1, Musashino
    Tokyo 180-8633, Japan
;
    'Tsubomura, Taro'
;
    Department of Applied Chemistry
    Faculty of Engineering
    Seikei University
    Kichijoji-Kitamachi 3-3-1, Musashino
    Tokyo 180-8633, Japan
;
data_I
_chemical_name_systematic
;
cis-Diammine(L-pyrolglutamato)platinum(II)
;
_chemical_name_common     ?
_chemical_formula_moiety     'C32 H30 N6 Pt 4+, 4Cl O4 -'
_chemical_formula_sum     'C32 H30 Cl4 N6 O16 Pt'
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac     '[Pt (C10 H8 N2) (C11 H11 N2)2] (Cl O4)4'
_chemical_formula_weight     1091.51
_symmetry_cell_setting     'Monoclinic'
_symmetry_space_group_name_H-M     'P 21/n'
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'
_cell_length_a     10.0690(9)
_cell_length_b     35.111(3)
_cell_length_c     11.7298(10)
_cell_angle_alpha     90.00
_cell_angle_beta     101.835(2)
_cell_angle_gamma     90.00
_cell_volume     4058.8(6)
_cell_formula_units_Z     4
_cell_measurement_reflns_used     6625
_cell_measurement_theta_min     2.37
_cell_measurement_theta_max     28.23
_cell_measurement_temperature     296(2)
_cell_special_details
;
;
_exptl_crystal_description     plate
_exptl_crystal_colour     'pale yellow'
_exptl_crystal_size_max     0.18
_exptl_crystal_size_mid     0.05
_exptl_crystal_size_min     0.03
_exptl_crystal_size_rad     ?
_exptl_crystal_density_diffrn     1.786
_exptl_crystal_density_meas     'not measured'
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000     2152
_exptl_absorpt_coefficient_mu     3.798
_exptl_absorpt_correction_type     Gaussian
_exptl_absorpt_process_details     '(XPREP in SAINT; Bruker, 2001)'
_exptl_absorpt_correction_T_min     0.2511
_exptl_absorpt_correction_T_max     0.5312
_exptl_special_details
;
The first 50 frames were rescanned at the end of data collection to
evaluate any possible decay phenomenon.  Since it was judged to be
negligible, no decay correction was applied to the data.
;
_diffrn_ambient_temperature     296(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_source     'fine-focus sealed tube'
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device     'Bruker SMART APEX CCD-detector'
_diffrn_measurement_method     ω
_diffrn_detector_area_resol_mean     8.366
_diffrn_reflns_number     25018
_diffrn_reflns_av_R_equivalents     0.0796
_diffrn_reflns_av_sigmaI/netI     0.0695
_diffrn_reflns_theta_min     2.32
_diffrn_reflns_theta_max     28.29
_diffrn_reflns_theta_full     28.29
_diffrn_measured_fraction_theta_max     0.926
_diffrn_measured_fraction_theta_full     0.926
_diffrn_reflns_limit_h_min     -10
_diffrn_reflns_limit_h_max     13
_diffrn_reflns_limit_k_min     -45
_diffrn_reflns_limit_k_max     41
_diffrn_reflns_limit_l_min     -15
_diffrn_reflns_limit_l_max     14
_diffrn_standards_number     352
_diffrn_standards_interval_count     ?
_diffrn_standards_interval_time     330
_diffrn_standards_decay_%     'variation 0.735'
loop_
    _diffrn_standard_refln_index_h
    _diffrn_standard_refln_index_k
    _diffrn_standard_refln_index_l
    0 0 -4
    0 0 -6
    10 7 -9
_refine_special_details
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;
_reflns_number_total     9347
_reflns_number_gt     7198
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0617
_refine_ls_R_factor_gt     0.0471
_refine_ls_wR_factor_gt     0.1200
_refine_ls_wR_factor_ref     0.1263
_refine_ls_goodness_of_fit_ref     1.014
_refine_ls_restrained_S_all     1.033
_refine_ls_number_reflns     9347
_refine_ls_number_parameters     511
_refine_ls_number_restraints     76
_refine_ls_hydrogen_treatment     constr
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
             'calc w = 1/[σ²(Fo²)+(0.0668P)²] where P = (Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary     difmap
_refine_ls_shift/su_max     0.001
_refine_ls_shift/su_mean     0.000
_refine_diff_density_max     2.527
_refine_diff_density_min     -1.088
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
_refine_ls_extinction_expression     not_defined
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'
    'O' 'O' 0.0106 0.0060
                         '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'
_computing_data_collection     'SMART (Bruker, 2001)'
_computing_cell_refinement     'SAINT (Bruker, 2001)'
_computing_data_reduction     'SAINT'
_computing_structure_solution     'SHELXS97 (Sheldrick, 1997)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 1997)'
_computing_molecular_graphics     'KENX (Sakai, 2002)'
_computing_publication_material
;
SHELXL97 (Sheldrick, 1997), TEXSAN (Molecular Structure Corporation, 2001),
KENX (Sakai, 2002) and ORTEPII (Johnson, 1976)
;
loop_
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    _atom_site_adp_type
    _atom_site_calc_flag
    _atom_site_refinement_flags
    _atom_site_occupancy
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    _atom_site_type_symbol
    Pt1 0.81203(2) 0.061922(6) 0.22926(2) 0.03961(9) Uani d . 1 . . Pt
    Cl1 0.19657(15) 0.12531(4) 0.21616(15) 0.0557(4) Uani d . 1 . . Cl
    Cl2 -0.14634(19) 0.14000(6) -0.30342(16) 0.0745(5) Uani d . 1 . . Cl
    Cl3 0.49027(17) 0.23826(4) -0.19715(17) 0.0633(4) Uani d D 1 . . Cl
    Cl4 1.5058(2) 0.01782(5) 0.7512(2) 0.0881(7) Uani d D 1 . . Cl
    O1 0.1959(8) 0.13890(19) 0.3292(6) 0.112(2) Uani d . 1 . . O
    O2 0.2762(6) 0.09182(16) 0.2221(5) 0.0947(18) Uani d . 1 . . O
    O3 0.2512(7) 0.15412(18) 0.1555(7) 0.114(2) Uani d . 1 . . O
    O4 0.0624(6) 0.1173(2) 0.1581(6) 0.113(2) Uani d . 1 . . O
    O5 -0.1328(7) 0.17984(19) -0.3073(7) 0.123(3) Uani d . 1 . . O
    O6 -0.0635(8) 0.1237(2) -0.3732(7) 0.125(3) Uani d . 1 . . O
    O7 -0.0998(6) 0.12793(17) -0.1867(5) 0.0909(17) Uani d . 1 . . O
    O8A -0.2979(10) 0.1393(3) -0.3381(9) 0.069(3) Uiso d P 0.50 . . O
    O8B -0.2654(15) 0.1164(4) -0.3355(13) 0.111(4) Uiso d P 0.50 . . O
    O9A 0.5682(14) 0.2725(4) -0.2082(14) 0.0866(12) Uiso d PD 0.50 . . O
    O9B 0.5464(14) 0.2747(4) -0.2005(14) 0.0866(12) Uiso d PD 0.50 . . O
    O10A 0.4544(11) 0.2378(3) -0.0863(9) 0.0866(12) Uiso d PD 0.50 . . O
    O10B 0.4270(11) 0.2256(3) -0.3104(9) 0.0866(12) Uiso d PD 0.50 . . O
    O11A 0.3716(11) 0.2390(3) -0.2836(9) 0.0866(12) Uiso d PD 0.50 . . O
    O11B 0.3847(10) 0.2410(3) -0.1270(9) 0.0866(12) Uiso d PD 0.50 . . O
    O12A 0.5767(10) 0.2080(3) -0.2083(10) 0.0866(12) Uiso d PD 0.50 . . O
    O12B 0.5842(11) 0.2104(3) -0.1390(10) 0.0866(12) Uiso d PD 0.50 . . O
    O13A 1.3931(13) 0.0446(4) 0.7284(12) 0.1072(13) Uiso d PD 0.50 . . O
    O13B 1.5357(12) 0.0440(4) 0.6551(10) 0.1072(13) Uiso d PD 0.50 . . O
    O14A 1.5025(13) 0.0067(4) 0.8824(10) 0.1072(13) Uiso d PD 0.50 . . O
    O14B 1.3836(12) 0.0323(4) 0.7725(12) 0.1072(13) Uiso d PD 0.50 . . O
    O15A 1.4867(19) -0.0151(4) 0.6902(16) 0.1072(13) Uiso d PD 0.50 . . O
    O15B 1.4729(19) -0.0172(4) 0.6893(16) 0.1072(13) Uiso d PD 0.50 . . O
    O16A 1.6280(12) 0.0379(4) 0.7622(12) 0.1072(13) Uiso d PD 0.50 . . O
    O16B 1.6191(12) 0.0163(4) 0.8276(11) 0.1072(13) Uiso d PD 0.50 . . O
    N1 0.8652(4) 0.01565(12) 0.1502(4) 0.0396(10) Uani d . 1 . . N
    N2 0.9695(4) 0.04466(14) 0.3528(4) 0.0457(11) Uani d . 1 . . N
    N3 0.7556(4) 0.10696(12) 0.3146(4) 0.0443(11) Uani d . 1 . . N
    N4 0.4597(5) 0.27245(14) 0.4835(5) 0.0540(13) Uani d . 1 . . N
    N5 0.6685(4) 0.08028(12) 0.0930(4) 0.0402(10) Uani d . 1 . . N
    N6 0.2112(5) 0.16819(15) -0.3573(4) 0.0534(13) Uani d . 1 . . N
    C1 0.7996(6) 0.00167(16) 0.0481(5) 0.0486(13) Uani d . 1 . . C
    H1 0.7238 0.0146 0.0078 0.058 Uiso calc R 1 . . H
    C2 0.8389(6) -0.03073(17) 0.0005(6) 0.0544(15) Uani d . 1 . . C
    H2 0.7928 -0.0394 -0.0718 0.065 Uiso calc R 1 . . H
    C3 0.9475(7) -0.05019(19) 0.0617(7) 0.0658(19) Uani d . 1 . . C
    H3 0.9749 -0.0728 0.0322 0.079 Uiso calc R 1 . . H
    C4 1.0163(7) -0.03650(17) 0.1663(6) 0.0611(17) Uani d . 1 . . C
    H4 1.0912 -0.0495 0.2078 0.073 Uiso calc R 1 . . H
    C5 0.9738(5) -0.00326(15) 0.2096(5) 0.0457(13) Uani d . 1 . . C
    C6 1.0371(6) 0.01432(17) 0.3208(6) 0.0518(15) Uani d . 1 . . C
    C7 1.1599(7) 0.0024(2) 0.3889(7) 0.079(2) Uani d . 1 . . C
    H7 1.2101 -0.0170 0.3641 0.095 Uiso calc R 1 . . H
    C8 1.2046(9) 0.0203(3) 0.4942(8) 0.098(3) Uani d . 1 . . C
    H8 1.2835 0.0119 0.5435 0.118 Uiso calc R 1 . . H
    C9 1.1359(8) 0.0497(2) 0.5265(7) 0.080(2) Uani d . 1 . . C
    H9 1.1674 0.0620 0.5971 0.096 Uiso calc R 1 . . H
    C10 1.0158(8) 0.06181(19) 0.4521(6) 0.0642(19) Uani d . 1 . . C
    H10 0.9682 0.0824 0.4737 0.077 Uiso calc R 1 . . H
    C11 0.6423(7) 0.10514(17) 0.3558(6) 0.0564(15) Uani d . 1 . . C
    H11 0.6014 0.0816 0.3600 0.068 Uiso calc R 1 . . H
    C12 0.5830(6) 0.13737(17) 0.3927(6) 0.0576(16) Uani d . 1 . . C
    H12 0.5023 0.1353 0.4192 0.069 Uiso calc R 1 . . H
    C13 0.6446(6) 0.17250(16) 0.3899(5) 0.0488(14) Uani d . 1 . . C
    C14 0.7661(6) 0.17385(17) 0.3539(6) 0.0533(15) Uani d . 1 . . C
    H14 0.8128 0.1968 0.3558 0.064 Uiso calc R 1 . . H
    C15 0.8190(6) 0.14113(16) 0.3149(6) 0.0522(15) Uani d . 1 . . C
    H15 0.8997 0.1425 0.2884 0.063 Uiso calc R 1 . . H
    C16 0.5809(6) 0.20762(16) 0.4234(5) 0.0488(14) Uani d . 1 . . C
    C17 0.4459(6) 0.21435(18) 0.3806(6) 0.0627(18) Uani d . 1 . . C
    H17 0.3937 0.1968 0.3313 0.075 Uiso calc R 1 . . H
    C18 0.3889(7) 0.24720(19) 0.4111(7) 0.0645(18) Uani d . 1 . . C
    H18 0.2978 0.2520 0.3802 0.077 Uiso calc R 1 . . H
    C19 0.5925(7) 0.26619(19) 0.5248(6) 0.0636(17) Uani d . 1 . . C
    H19 0.6431 0.2842 0.5735 0.076 Uiso calc R 1 . . H
    C20 0.6540(7) 0.23418(17) 0.4968(6) 0.0590(16) Uani d . 1 . . C
    H20 0.7457 0.2302 0.5273 0.071 Uiso calc R 1 . . H
    C21 0.3945(8) 0.30679(19) 0.5177(7) 0.078(2) Uani d . 1 . . C
    H21A 0.3907 0.3260 0.4588 0.116 Uiso calc R 1 . . H
    H21B 0.4460 0.3161 0.5904 0.116 Uiso calc R 1 . . H
    H21C 0.3041 0.3007 0.5264 0.116 Uiso calc R 1 . . H
    C22 0.5352(6) 0.07862(18) 0.0907(6) 0.0508(14) Uani d . 1 . . C
    H22 0.5055 0.0664 0.1512 0.061 Uiso calc R 1 . . H
    C23 0.4420(6) 0.09414(17) 0.0033(5) 0.0512(14) Uani d . 1 . . C
    H23 0.3501 0.0922 0.0042 0.061 Uiso calc R 1 . . H
    C24 0.4822(5) 0.11265(15) -0.0860(5) 0.0427(12) Uani d . 1 . . C
    C25 0.6216(6) 0.11445(17) -0.0857(5) 0.0521(15) Uani d . 1 . . C
    H25 0.6530 0.1263 -0.1460 0.063 Uiso calc R 1 . . H
    C26 0.7095(6) 0.09835(17) 0.0051(5) 0.0519(14) Uani d . 1 . . C
    H26 0.8020 0.0999 0.0065 0.062 Uiso calc R 1 . . H
    C27 0.3845(5) 0.13086(16) -0.1825(5) 0.0446(13) Uani d . 1 . . C
    C28 0.2786(6) 0.15169(18) -0.1594(6) 0.0549(15) Uani d . 1 . . C
    H28 0.2639 0.1530 -0.0838 0.066 Uiso calc R 1 . . H
    C29 0.1941(6) 0.1707(2) -0.2471(5) 0.0552(16) Uani d . 1 . . C
    H29 0.1240 0.1855 -0.2302 0.066 Uiso calc R 1 . . H
    C30 0.3109(7) 0.14722(19) -0.3813(5) 0.0598(17) Uani d . 1 . . C
    H30 0.3212 0.1456 -0.4581 0.072 Uiso calc R 1 . . H
    C31 0.3989(7) 0.12798(19) -0.2979(6) 0.0575(16) Uani d . 1 . . C
    H31 0.4676 0.1132 -0.3173 0.069 Uiso calc R 1 . . H
    C32 0.1247(7) 0.1913(2) -0.4477(7) 0.081(2) Uani d . 1 . . C
    H32A 0.1696 0.2148 -0.4568 0.122 Uiso calc R 1 . . H
    H32B 0.0401 0.1964 -0.4252 0.122 Uiso calc R 1 . . H
    H32C 0.1080 0.1776 -0.5201 0.122 Uiso calc R 1 . . H
_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
Mean-plane data from final SHELXL refinement run:-
 Least-squares planes (x,y,z in crystal coordinates) and deviations from them
 (* indicates atom used to define plane)
  7.1005 (0.0175) x + 20.1717 (0.0494) y - 6.4669 (0.0234) z = 5.5029
(0.0181)
 *   -0.0149 (0.0011)  N1
 *    0.0003 (0.0001)  N2
 *   -0.0147 (0.0011)  N3
 *    0.0294 (0.0022)  Pt1
      0.2617 (0.0081)  N5
 Rms deviation of fitted atoms =   0.0181
  7.1443 (0.0199) x + 18.5206 (0.0803) y - 7.0712 (0.0243) z = 5.4100
(0.0198)
 Angle to previous plane (with approximate esd) =  4.01 ( 0.38 )
 *   -0.0068 (0.0043)  C1
 *    0.0101 (0.0048)  C2
 *   -0.0063 (0.0053)  C3
 *   -0.0009 (0.0051)  C4
 *    0.0046 (0.0043)  C5
 *   -0.0007 (0.0039)  N1
 Rms deviation of fitted atoms =   0.0059
  6.2916 (0.0276) x + 22.1939 (0.0977) y - 6.7645 (0.0322) z = 4.6965
(0.0328)
 Angle to previous plane (with approximate esd) =  7.74 ( 0.47 )
 *   -0.0241 (0.0051)  C6
 *    0.0243 (0.0063)  C7
 *   -0.0091 (0.0072)  C8
 *   -0.0070 (0.0066)  C9
 *    0.0080 (0.0055)  C10
 *    0.0078 (0.0047)  N2
 Rms deviation of fitted atoms =   0.0154
  7.1005 (0.0175) x + 20.1717 (0.0494) y - 6.4669 (0.0234) z = 5.5029
(0.0181)
 Angle to previous plane (with approximate esd) =  6.17 ( 0.45 )
 *   -0.0149 (0.0011)  N1
 *    0.0003 (0.0001)  N2
 *   -0.0147 (0.0011)  N3
 *    0.0294 (0.0022)  Pt1
      0.2617 (0.0081)  N5
 Rms deviation of fitted atoms =   0.0181
  6.7150 (0.0171) x + 20.3325 (0.0583) y - 6.9881 (0.0092) z = 5.0003
(0.0167)
 Angle to previous plane (with approximate esd) =  3.78 ( 0.32 )
 *    0.0667 (0.0051)  C1
 *    0.0041 (0.0057)  C2
 *   -0.0892 (0.0064)  C3
 *   -0.0799 (0.0065)  C4
 *    0.0078 (0.0057)  C5
 *    0.0784 (0.0045)  N1
 *    0.0128 (0.0065)  C6
 *    0.1202 (0.0078)  C7
 *    0.0488 (0.0085)  C8
 *   -0.0401 (0.0078)  C9
 *   -0.0819 (0.0063)  C10
 *   -0.0475 (0.0049)  N2
 Rms deviation of fitted atoms =   0.0662
  7.1005 (0.0175) x + 20.1717 (0.0494) y - 6.4669 (0.0234) z = 5.5029
(0.0181)
 Angle to previous plane (with approximate esd) =  3.78 ( 0.32 )
 *   -0.0149 (0.0011)  N1
 *    0.0003 (0.0001)  N2
 *   -0.0147 (0.0011)  N3
 *    0.0294 (0.0022)  Pt1
      0.2617 (0.0081)  N5
 Rms deviation of fitted atoms =   0.0181
  3.3357 (0.0261) x - 5.7210 (0.0838) y + 9.8724 (0.0167) z = 5.0340
(0.0201)
 Angle to previous plane (with approximate esd) = 75.75 ( 0.18 )
 *    0.0194 (0.0045)  C11
 *    0.0020 (0.0046)  C12
 *   -0.0218 (0.0043)  C13
 *    0.0211 (0.0044)  C14
 *   -0.0004 (0.0042)  C15
 *   -0.0202 (0.0039)  N3
 Rms deviation of fitted atoms =   0.0169
  4.0108 (0.0299) x + 16.6098 (0.0895) y - 9.9801 (0.0192) z = 1.5541
(0.0339)
 Angle to previous plane (with approximate esd) = 47.51 ( 0.20 )
 *   -0.0014 (0.0050)  C16
 *   -0.0031 (0.0053)  C17
 *    0.0090 (0.0053)  C18
 *    0.0057 (0.0050)  C19
 *    0.0000 (0.0051)  C20
 *   -0.0103 (0.0047)  N4
 Rms deviation of fitted atoms =   0.0062
  7.1005 (0.0175) x + 20.1717 (0.0494) y - 6.4669 (0.0234) z = 5.5029
(0.0181)
 Angle to previous plane (with approximate esd) = 28.45 ( 0.31 )
 *   -0.0149 (0.0011)  N1
 *    0.0003 (0.0001)  N2
 *   -0.0147 (0.0011)  N3
 *    0.0294 (0.0022)  Pt1
      0.2617 (0.0081)  N5
 Rms deviation of fitted atoms =   0.0181
 - 0.4889 (0.0256) x + 30.2178 (0.0451) y + 5.9365 (0.0262) z = 2.6519
(0.0167)
 Angle to previous plane (with approximate esd) = 75.55 ( 0.16 )
 *    0.0007 (0.0042)  C22
 *   -0.0037 (0.0044)  C23
 *    0.0063 (0.0041)  C24
 *   -0.0062 (0.0043)  C25
 *    0.0035 (0.0042)  C26
 *   -0.0007 (0.0038)  N5
 Rms deviation of fitted atoms =   0.0042
  5.8657 (0.0214) x + 28.0927 (0.0524) y + 0.2412 (0.0293) z = 5.8711
(0.0099)
 Angle to previous plane (with approximate esd) = 42.88 ( 0.20 )
 *    0.0163 (0.0042)  C27
 *   -0.0140 (0.0045)  C28
 *    0.0027 (0.0046)  C29
 *   -0.0036 (0.0045)  C30
 *   -0.0077 (0.0044)  C31
 *    0.0063 (0.0043)  N6
 Rms deviation of fitted atoms =   0.0098
  7.1005 (0.0175) x + 20.1717 (0.0494) y - 6.4669 (0.0234) z = 5.5029
(0.0181)
 Angle to previous plane (with approximate esd) = 35.81 ( 0.22 )
 *   -0.0149 (0.0011)  N1
 *    0.0003 (0.0001)  N2
 *   -0.0147 (0.0011)  N3
 *    0.0294 (0.0022)  Pt1
      0.2617 (0.0081)  N5
 Rms deviation of fitted atoms =   0.0181
  7.1443 (0.0199) x + 18.5206 (0.0803) y - 7.0712 (0.0243) z = 5.4100
(0.0198)
 Angle to previous plane (with approximate esd) =  4.01 ( 0.38 )
 *   -0.0068 (0.0043)  C1
 *    0.0101 (0.0048)  C2
 *   -0.0063 (0.0053)  C3
 *   -0.0009 (0.0051)  C4
 *    0.0046 (0.0043)  C5
 *   -0.0007 (0.0039)  N1
      3.4754 (0.0078)  C1_$6
      3.4585 (0.0076)  C2_$6
      3.4750 (0.0087)  C3_$6
      3.4696 (0.0079)  C4_$6
      3.4641 (0.0077)  C5_$6
      3.4693 (0.0075)  N1_$6
 Rms deviation of fitted atoms =   0.0059
  6.2916 (0.0276) x + 22.1939 (0.0977) y - 6.7645 (0.0322) z = 4.6965
(0.0328)
 Angle to previous plane (with approximate esd) =  7.74 ( 0.47 )
 *   -0.0241 (0.0051)  C6
 *    0.0243 (0.0063)  C7
 *   -0.0091 (0.0072)  C8
 *   -0.0070 (0.0066)  C9
 *    0.0080 (0.0055)  C10
 *    0.0078 (0.0047)  N2
     -3.5502 (0.0086)  C6_$7
     -3.5986 (0.0094)  C7_$7
     -3.5651 (0.0101)  C8_$7
     -3.5673 (0.0093)  C9_$7
     -3.5822 (0.0091)  C10_$7
     -3.5821 (0.0082)  N2_$7
 Rms deviation of fitted atoms =   0.0154
;
loop_
    _geom_bond_atom_site_label_1
    _geom_bond_atom_site_label_2
    _geom_bond_site_symmetry_2
    _geom_bond_distance
    _geom_bond_publ_flag
    Pt1 N1 . 1.997(4) yes
    Pt1 N2 . 2.009(4) yes
    Pt1 N3 . 2.015(4) yes
    Pt1 N5 . 2.028(4) yes
    Pt1 Pt1 3_756 7.9822(6) yes
    Pt1 Pt1 3_755 8.3972(6) yes
    Pt1 Pt1 3_655 8.5707(6) yes
    Cl1 O1 . 1.411(6) ?
    Cl1 O2 . 1.417(5) ?
    Cl1 O3 . 1.412(6) ?
    Cl1 O4 . 1.410(6) ?
    Cl2 O5 . 1.407(7) ?
    Cl2 O6 . 1.404(7) ?
    Cl2 O7 . 1.418(6) ?
    Cl2 O8A . 1.497(10) ?
    Cl2 O8B . 1.443(14) ?
    Cl3 O9A . 1.456(12) ?
    Cl3 O9B . 1.402(12) ?
    Cl3 O10A . 1.419(10) ?
    Cl3 O10B . 1.422(10) ?
    Cl3 O11A . 1.400(10) ?
    Cl3 O11B . 1.475(10) ?
    Cl3 O12A . 1.398(10) ?
    Cl3 O12B . 1.432(10) ?
    Cl4 O13A . 1.455(12) ?
    Cl4 O13B . 1.533(11) ?
    Cl4 O14A . 1.594(12) ?
    Cl4 O14B . 1.400(12) ?
    Cl4 O15A . 1.351(14) ?
    Cl4 O15B . 1.431(14) ?
    Cl4 O16A . 1.400(11) ?
    Cl4 O16B . 1.299(11) ?
    N1 C1 . 1.337(7) ?
    N1 C5 . 1.344(6) ?
    N2 C6 . 1.358(8) ?
    N2 C10 . 1.309(8) ?
    N3 C11 . 1.328(8) ?
    N3 C15 . 1.359(7) ?
    N4 C18 . 1.329(8) ?
    N4 C19 . 1.343(8) ?
    N4 C21 . 1.468(8) ?
    N5 C22 . 1.338(7) ?
    N5 C26 . 1.345(7) ?
    N6 C30 . 1.321(8) ?
    N6 C29 . 1.341(7) ?
    N6 C32 . 1.469(7) ?
    C1 C2 . 1.361(8) ?
    C1 H1 . 0.9300 ?
    C2 C3 . 1.362(9) ?
    C2 H2 . 0.9300 ?
    C3 C4 . 1.367(10) ?
    C3 H3 . 0.9300 ?
    C4 C5 . 1.376(8) ?
    C4 H4 . 0.9300 ?
    C5 C6 . 1.466(8) ?
    C6 C7 . 1.392(8) ?
    C7 C8 . 1.376(11) ?
    C7 H7 . 0.9300 ?
    C8 C9 . 1.341(11) ?
    C8 H8 . 0.9300 ?
    C9 C10 . 1.404(10) ?
    C9 H9 . 0.9300 ?
    C10 H10 . 0.9300 ?
    C11 C12 . 1.390(8) ?
    C11 H11 . 0.9300 ?
    C12 C13 . 1.384(8) ?
    C12 H12 . 0.9300 ?
    C13 C14 . 1.374(8) ?
    C13 C16 . 1.480(8) ?
    C14 C15 . 1.382(8) ?
    C14 H14 . 0.9300 ?
    C15 H15 . 0.9300 ?
    C16 C17 . 1.369(8) ?
    C16 C20 . 1.376(8) ?
    C17 C18 . 1.369(9) ?
    C17 H17 . 0.9300 ?
    C18 H18 . 0.9300 ?
    C19 C20 . 1.356(8) ?
    C19 H19 . 0.9300 ?
    C20 H20 . 0.9300 ?
    C21 H21A . 0.9600 ?
    C21 H21B . 0.9600 ?
    C21 H21C . 0.9600 ?
    C22 C23 . 1.354(8) ?
    C22 H22 . 0.9300 ?
    C23 C24 . 1.362(8) ?
    C23 H23 . 0.9300 ?
    C24 C25 . 1.405(8) ?
    C24 C27 . 1.484(7) ?
    C25 C26 . 1.361(7) ?
    C25 H25 . 0.9300 ?
    C26 H26 . 0.9300 ?
    C27 C28 . 1.365(8) ?
    C27 C31 . 1.394(9) ?
    C28 C29 . 1.367(8) ?
    C28 H28 . 0.9300 ?
    C29 H29 . 0.9300 ?
    C30 C31 . 1.358(8) ?
    C30 H30 . 0.9300 ?
    C31 H31 . 0.9300 ?
    C32 H32A . 0.9600 ?
    C32 H32B . 0.9600 ?
    C32 H32C . 0.9600 ?
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_3
    _geom_angle
    _geom_angle_publ_flag
    N1 Pt1 N2 . . 80.93(18) yes
    N1 Pt1 N3 . . 177.29(19) yes
    N2 Pt1 N3 . . 98.04(19) yes
    N1 Pt1 N5 . . 96.22(17) yes
    N2 Pt1 N5 . . 173.5(2) yes
    N3 Pt1 N5 . . 85.05(17) yes
    O4 Cl1 O1 . . 109.4(5) ?
    O1 Cl1 O2 . . 110.3(4) ?
    O3 Cl1 O2 . . 110.2(4) ?
    O4 Cl1 O2 . . 109.6(4) ?
    O1 Cl1 O3 . . 108.0(5) ?
    O4 Cl1 O3 . . 109.4(4) ?
    O6 Cl2 O5 . . 108.2(5) ?
    O5 Cl2 O7 . . 108.2(5) ?
    O6 Cl2 O7 . . 108.8(5) ?
    O5 Cl2 O8A . . 96.2(5) ?
    O6 Cl2 O8A . . 122.0(5) ?
    O7 Cl2 O8A . . 112.0(5) ?
    O5 Cl2 O8B . . 130.1(7) ?
    O6 Cl2 O8B . . 100.1(7) ?
    O7 Cl2 O8B . . 99.9(7) ?
    O10A Cl3 O9A . . 109.5(7) ?
    O11A Cl3 O9A . . 108.3(7) ?
    O12A Cl3 O9A . . 105.2(6) ?
    O11A Cl3 O10A . . 108.9(6) ?
    O12A Cl3 O10A . . 110.9(6) ?
    O9B Cl3 O10B . . 111.4(7) ?
    O12A Cl3 O11A . . 113.7(6) ?
    O9B Cl3 O11B . . 107.3(6) ?
    O10B Cl3 O11B . . 107.8(6) ?
    O12B Cl3 O11B . . 105.1(6) ?
    O9B Cl3 O12B . . 113.9(7) ?
    O10B Cl3 O12B . . 110.9(6) ?
    O15A Cl4 O13A . . 115.6(8) ?
    O16A Cl4 O13A . . 109.2(7) ?
    O14B Cl4 O13B . . 103.0(6) ?
    O15B Cl4 O13B . . 101.7(8) ?
    O16B Cl4 O13B . . 104.7(7) ?
    O13A Cl4 O14A . . 99.5(7) ?
    O15A Cl4 O14A . . 105.8(8) ?
    O16A Cl4 O14A . . 103.1(6) ?
    O16B Cl4 O14B . . 124.9(8) ?
    O14B Cl4 O15B . . 106.4(8) ?
    O16B Cl4 O15B . . 113.2(8) ?
    O15A Cl4 O16A . . 120.4(9) ?
    C1 N1 C5 . . 118.9(5) ?
    C1 N1 Pt1 . . 125.7(4) ?
    C5 N1 Pt1 . . 115.3(4) ?
    C10 N2 C6 . . 120.0(5) ?
    C10 N2 Pt1 . . 126.0(5) ?
    C6 N2 Pt1 . . 113.8(4) ?
    C11 N3 C15 . . 118.6(5) ?
    C11 N3 Pt1 . . 119.6(4) ?
    C15 N3 Pt1 . . 121.0(4) ?
    C18 N4 C19 . . 119.0(5) ?
    C18 N4 C21 . . 120.8(6) ?
    C19 N4 C21 . . 120.2(6) ?
    C22 N5 C26 . . 118.0(5) ?
    C22 N5 Pt1 . . 123.5(4) ?
    C26 N5 Pt1 . . 118.2(3) ?
    C30 N6 C29 . . 119.6(5) ?
    C30 N6 C32 . . 121.2(6) ?
    C29 N6 C32 . . 119.0(6) ?
    N1 C1 C2 . . 122.8(5) ?
    N1 C1 H1 . . 118.6 ?
    C2 C1 H1 . . 118.6 ?
    C1 C2 C3 . . 118.2(6) ?
    C1 C2 H2 . . 120.9 ?
    C3 C2 H2 . . 120.9 ?
    C2 C3 C4 . . 120.0(6) ?
    C2 C3 H3 . . 120.0 ?
    C4 C3 H3 . . 120.0 ?
    C3 C4 C5 . . 119.4(6) ?
    C3 C4 H4 . . 120.3 ?
    C5 C4 H4 . . 120.3 ?
    N1 C5 C4 . . 120.6(5) ?
    N1 C5 C6 . . 114.3(5) ?
    C4 C5 C6 . . 125.0(5) ?
    N2 C6 C7 . . 120.9(6) ?
    N2 C6 C5 . . 115.1(5) ?
    C7 C6 C5 . . 123.9(6) ?
    C8 C7 C6 . . 117.8(7) ?
    C8 C7 H7 . . 121.1 ?
    C6 C7 H7 . . 121.1 ?
    C9 C8 C7 . . 120.8(7) ?
    C9 C8 H8 . . 119.6 ?
    C7 C8 H8 . . 119.6 ?
    C8 C9 C10 . . 119.1(7) ?
    C8 C9 H9 . . 120.5 ?
    C10 C9 H9 . . 120.5 ?
    N2 C10 C9 . . 121.2(7) ?
    N2 C10 H10 . . 119.4 ?
    C9 C10 H10 . . 119.4 ?
    N3 C11 C12 . . 122.0(5) ?
    N3 C11 H11 . . 119.0 ?
    C12 C11 H11 . . 119.0 ?
    C13 C12 C11 . . 119.6(6) ?
    C13 C12 H12 . . 120.2 ?
    C11 C12 H12 . . 120.2 ?
    C14 C13 C12 . . 118.0(5) ?
    C14 C13 C16 . . 121.0(5) ?
    C12 C13 C16 . . 121.0(6) ?
    C13 C14 C15 . . 120.0(5) ?
    C13 C14 H14 . . 120.0 ?
    C15 C14 H14 . . 120.0 ?
    N3 C15 C14 . . 121.5(6) ?
    N3 C15 H15 . . 119.2 ?
    C14 C15 H15 . . 119.2 ?
    C17 C16 C20 . . 118.4(5) ?
    C17 C16 C13 . . 119.9(5) ?
    C20 C16 C13 . . 121.7(5) ?
    C18 C17 C16 . . 119.2(6) ?
    C18 C17 H17 . . 120.4 ?
    C16 C17 H17 . . 120.4 ?
    N4 C18 C17 . . 122.0(6) ?
    N4 C18 H18 . . 119.0 ?
    C17 C18 H18 . . 119.0 ?
    N4 C19 C20 . . 121.2(6) ?
    N4 C19 H19 . . 119.4 ?
    C20 C19 H19 . . 119.4 ?
    C19 C20 C16 . . 120.1(6) ?
    C19 C20 H20 . . 120.0 ?
    C16 C20 H20 . . 120.0 ?
    N4 C21 H21A . . 109.5 ?
    N4 C21 H21B . . 109.5 ?
    H21A C21 H21B . . 109.5 ?
    N4 C21 H21C . . 109.5 ?
    H21A C21 H21C . . 109.5 ?
    H21B C21 H21C . . 109.5 ?
    N5 C22 C23 . . 122.3(6) ?
    N5 C22 H22 . . 118.9 ?
    C23 C22 H22 . . 118.9 ?
    C22 C23 C24 . . 120.3(6) ?
    C22 C23 H23 . . 119.8 ?
    C24 C23 H23 . . 119.8 ?
    C23 C24 C25 . . 118.3(5) ?
    C23 C24 C27 . . 122.5(5) ?
    C25 C24 C27 . . 119.2(5) ?
    C26 C25 C24 . . 118.1(6) ?
    C26 C25 H25 . . 120.9 ?
    C24 C25 H25 . . 120.9 ?
    N5 C26 C25 . . 122.9(5) ?
    N5 C26 H26 . . 118.5 ?
    C25 C26 H26 . . 118.5 ?
    C28 C27 C31 . . 118.2(5) ?
    C28 C27 C24 . . 120.1(5) ?
    C31 C27 C24 . . 121.6(5) ?
    C27 C28 C29 . . 120.2(6) ?
    C27 C28 H28 . . 119.9 ?
    C29 C28 H28 . . 119.9 ?
    N6 C29 C28 . . 120.7(6) ?
    N6 C29 H29 . . 119.6 ?
    C28 C29 H29 . . 119.6 ?
    N6 C30 C31 . . 122.4(6) ?
    N6 C30 H30 . . 118.8 ?
    C31 C30 H30 . . 118.8 ?
    C30 C31 C27 . . 118.7(6) ?
    C30 C31 H31 . . 120.6 ?
    C27 C31 H31 . . 120.6 ?
    N6 C32 H32A . . 109.5 ?
    N6 C32 H32B . . 109.5 ?
    H32A C32 H32B . . 109.5 ?
    N6 C32 H32C . . 109.5 ?
    H32A C32 H32C . . 109.5 ?
    H32B C32 H32C . . 109.5 ?
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
    N2 Pt1 N1 C1 . . . . 175.6(5) ?
    N3 Pt1 N1 C1 . . . . 108(4) ?
    N5 Pt1 N1 C1 . . . . -10.2(5) ?
    N2 Pt1 N1 C5 . . . . -1.5(4) ?
    N3 Pt1 N1 C5 . . . . -69(4) ?
    N5 Pt1 N1 C5 . . . . 172.7(4) ?
    N1 Pt1 N2 C10 . . . . 178.8(6) ?
    N3 Pt1 N2 C10 . . . . -3.7(6) ?
    N5 Pt1 N2 C10 . . . . 114.6(15) ?
    N1 Pt1 N2 C6 . . . . 5.0(4) ?
    N3 Pt1 N2 C6 . . . . -177.6(4) ?
    N5 Pt1 N2 C6 . . . . -59.2(17) ?
    N1 Pt1 N3 C11 . . . . -40(4) ?
    N2 Pt1 N3 C11 . . . . -107.8(5) ?
    N5 Pt1 N3 C11 . . . . 77.9(5) ?
    N1 Pt1 N3 C15 . . . . 150(3) ?
    N2 Pt1 N3 C15 . . . . 82.6(4) ?
    N5 Pt1 N3 C15 . . . . -91.7(4) ?
    N1 Pt1 N5 C22 . . . . 108.2(5) ?
    N2 Pt1 N5 C22 . . . . 171.6(14) ?
    N3 Pt1 N5 C22 . . . . -69.4(5) ?
    N1 Pt1 N5 C26 . . . . -78.3(4) ?
    N2 Pt1 N5 C26 . . . . -14.9(17) ?
    N3 Pt1 N5 C26 . . . . 104.1(4) ?
    C5 N1 C1 C2 . . . . -0.9(9) ?
    Pt1 N1 C1 C2 . . . . -177.9(5) ?
    N1 C1 C2 C3 . . . . 1.9(10) ?
    C1 C2 C3 C4 . . . . -1.8(11) ?
    C2 C3 C4 C5 . . . . 0.8(11) ?
    C1 N1 C5 C4 . . . . -0.2(9) ?
    Pt1 N1 C5 C4 . . . . 177.1(5) ?
    C1 N1 C5 C6 . . . . -179.3(5) ?
    Pt1 N1 C5 C6 . . . . -2.0(7) ?
    C3 C4 C5 N1 . . . . 0.3(10) ?
    C3 C4 C5 C6 . . . . 179.3(7) ?
    C10 N2 C6 C7 . . . . -3.9(10) ?
    Pt1 N2 C6 C7 . . . . 170.3(6) ?
    C10 N2 C6 C5 . . . . 178.3(6) ?
    Pt1 N2 C6 C5 . . . . -7.4(7) ?
    N1 C5 C6 N2 . . . . 6.3(8) ?
    C4 C5 C6 N2 . . . . -172.8(6) ?
    N1 C5 C6 C7 . . . . -171.4(7) ?
    C4 C5 C6 C7 . . . . 9.5(11) ?
    N2 C6 C7 C8 . . . . 5.4(12) ?
    C5 C6 C7 C8 . . . . -177.0(8) ?
    C6 C7 C8 C9 . . . . -3.9(15) ?
    C7 C8 C9 C10 . . . . 1.0(15) ?
    C6 N2 C10 C9 . . . . 0.8(11) ?
    Pt1 N2 C10 C9 . . . . -172.6(6) ?
    C8 C9 C10 N2 . . . . 0.6(13) ?
    C15 N3 C11 C12 . . . . 3.8(9) ?
    Pt1 N3 C11 C12 . . . . -166.0(5) ?
    N3 C11 C12 C13 . . . . -1.7(10) ?
    C11 C12 C13 C14 . . . . -2.3(10) ?
    C11 C12 C13 C16 . . . . 177.1(6) ?
    C12 C13 C14 C15 . . . . 4.1(9) ?
    C16 C13 C14 C15 . . . . -175.3(6) ?
    C11 N3 C15 C14 . . . . -1.9(9) ?
    Pt1 N3 C15 C14 . . . . 167.8(5) ?
    C13 C14 C15 N3 . . . . -2.1(10) ?
    C14 C13 C16 C17 . . . . 132.7(7) ?
    C12 C13 C16 C17 . . . . -46.7(9) ?
    C14 C13 C16 C20 . . . . -47.0(9) ?
    C12 C13 C16 C20 . . . . 133.6(7) ?
    C20 C16 C17 C18 . . . . 0.6(11) ?
    C13 C16 C17 C18 . . . . -179.1(7) ?
    C19 N4 C18 C17 . . . . 2.4(11) ?
    C21 N4 C18 C17 . . . . -177.9(7) ?
    C16 C17 C18 N4 . . . . -1.7(12) ?
    C18 N4 C19 C20 . . . . -2.0(11) ?
    C21 N4 C19 C20 . . . . 178.2(7) ?
    N4 C19 C20 C16 . . . . 1.0(11) ?
    C17 C16 C20 C19 . . . . -0.3(11) ?
    C13 C16 C20 C19 . . . . 179.4(7) ?
    C26 N5 C22 C23 . . . . 0.5(9) ?
    Pt1 N5 C22 C23 . . . . 174.0(5) ?
    N5 C22 C23 C24 . . . . -0.8(10) ?
    C22 C23 C24 C25 . . . . 1.3(9) ?
    C22 C23 C24 C27 . . . . -178.7(6) ?
    C23 C24 C25 C26 . . . . -1.5(9) ?
    C27 C24 C25 C26 . . . . 178.4(5) ?
    C22 N5 C26 C25 . . . . -0.8(9) ?
    Pt1 N5 C26 C25 . . . . -174.6(5) ?
    C24 C25 C26 N5 . . . . 1.3(9) ?
    C23 C24 C27 C28 . . . . 43.0(8) ?
    C25 C24 C27 C28 . . . . -136.9(6) ?
    C23 C24 C27 C31 . . . . -138.3(6) ?
    C25 C24 C27 C31 . . . . 41.8(8) ?
    C31 C27 C28 C29 . . . . -3.4(9) ?
    C24 C27 C28 C29 . . . . 175.4(6) ?
    C30 N6 C29 C28 . . . . -0.1(10) ?
    C32 N6 C29 C28 . . . . -175.5(6) ?
    C27 C28 C29 N6 . . . . 2.1(10) ?
    C29 N6 C30 C31 . . . . -0.5(10) ?
    C32 N6 C30 C31 . . . . 174.7(6) ?
    N6 C30 C31 C27 . . . . -0.8(10) ?
    C28 C27 C31 C30 . . . . 2.7(9) ?
    C24 C27 C31 C30 . . . . -176.0(6) ?
