#------------------------------------------------------------------------------
#$Date: 2016-03-26 21:39:43 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180480 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/49/7214926.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_7214926
loop_
_publ_author_name
'Tzeng, Biing-Chiau'
'Ding, Chau-Shiung'
'Chang, Tsung-Yi'
'Hu, Cho-Chun'
'Lee, Gene-Hsiang'
_publ_section_title
;
 Toward heteronuclear supramolecular architectures of pyridine-4-thiolate
;
_journal_issue                   23
_journal_name_full               CrystEngComm
_journal_page_first              8228
_journal_paper_doi               10.1039/c2ce26367j
_journal_volume                  14
_journal_year                    2012
_chemical_formula_sum            'C60 H80 N10 O11 Pt2 S4 Zn2'
_chemical_formula_weight         1766.50
_chemical_name_systematic
;
?
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 119.2720(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   27.540(3)
_cell_length_b                   19.1614(17)
_cell_length_c                   16.0561(15)
_cell_measurement_reflns_used    35221
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.00
_cell_measurement_theta_min      1.36
_cell_volume                     7391.0(12)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_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 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker SMART ApexCCD'
_diffrn_measurement_method       'ω 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  0.0409
_diffrn_reflns_av_sigmaI/netI    0.0311
_diffrn_reflns_limit_h_max       32
_diffrn_reflns_limit_h_min       -32
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            35221
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.36
_exptl_absorpt_coefficient_mu    4.586
_exptl_absorpt_correction_T_max  0.8031
_exptl_absorpt_correction_T_min  0.7396
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.588
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       cuboid
_exptl_crystal_F_000             3512
_exptl_crystal_size_max          0.07
_exptl_crystal_size_mid          0.06
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.493
_refine_diff_density_min         -0.673
_refine_diff_density_rms         0.287
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.127
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     427
_refine_ls_number_reflns         6518
_refine_ls_number_restraints     124
_refine_ls_restrained_S_all      1.127
_refine_ls_R_factor_all          0.0636
_refine_ls_R_factor_gt           0.0469
_refine_ls_shift/su_max          0.017
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0977P)²+7.7026P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1383
_refine_ls_wR_factor_ref         0.1564
_reflns_number_gt                5223
_reflns_number_total             6518
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2ce26367j.txt
_cod_data_source_block           bct-5
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/automatic-downloads/retrospective/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7214926
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -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
Pt1 Pt 0.216360(12) 0.192355(15) 0.89258(2) 0.04789(15) Uani 1 1 d . . .
Zn1 Zn 0.01741(4) 0.09893(5) 0.36691(7) 0.0606(3) Uani 1 1 d . . .
S1 S 0.19622(10) 0.25642(12) 0.75948(16) 0.0672(6) Uani 1 1 d . A .
S2 S 0.12499(9) 0.20452(11) 0.85336(17) 0.0597(6) Uani 1 1 d . . .
O1 O -0.0487(8) 0.0570(10) 0.3727(13) 0.092(4) Uani 0.68(3) 1 d PU A 3
O2 O -0.0579(9) 0.1621(13) 0.3742(17) 0.135(5) Uani 0.68(3) 1 d PU A 3
O3 O -0.1134(7) 0.1081(14) 0.3902(13) 0.129(5) Uani 0.68(3) 1 d PU A 3
O1' O -0.0381(18) 0.055(2) 0.410(3) 0.092(4) Uani 0.32(3) 1 d PU A 4
O2' O -0.044(2) 0.159(3) 0.423(4) 0.135(5) Uani 0.32(3) 1 d PU A 4
O3' O -0.1125(15) 0.064(3) 0.394(3) 0.129(5) Uani 0.32(3) 1 d PU A 4
O4 O 0.0000 0.1438(5) 0.2500 0.080(3) Uani 1 2 d S . .
N1 N 0.2428(3) 0.1369(3) 1.0167(4) 0.0488(15) Uani 1 1 d . . .
N2 N 0.3001(3) 0.1812(3) 0.9384(5) 0.0504(16) Uani 1 1 d . . .
N3 N 0.0750(3) 0.1455(4) 0.4867(5) 0.0598(18) Uani 1 1 d . A .
N4 N 0.0503(3) -0.0050(4) 0.8656(5) 0.0580(17) Uani 1 1 d . . .
N5 N -0.0737(4) 0.1006(8) 0.3842(8) 0.104(3) Uani 1 1 d . . .
C1 C 0.2124(3) 0.1207(4) 1.0589(6) 0.058(2) Uani 1 1 d . . .
H1 H 0.1771 0.1399 1.0345 0.070 Uiso 1 1 calc R . .
C2 C 0.2310(4) 0.0780(5) 1.1348(6) 0.068(2) Uani 1 1 d . . .
H2 H 0.2083 0.0683 1.1613 0.082 Uiso 1 1 calc R . .
C3 C 0.2829(4) 0.0485(5) 1.1736(7) 0.076(3) Uani 1 1 d . B .
C4 C 0.3158(3) 0.0673(5) 1.1337(7) 0.067(2) Uani 1 1 d . . .
H4 H 0.3518 0.0499 1.1591 0.080 Uiso 1 1 calc R . .
C5 C 0.2950(3) 0.1117(4) 1.0566(5) 0.0492(18) Uani 1 1 d . . .
C6 C 0.3274(3) 0.1384(4) 1.0127(5) 0.0498(18) Uani 1 1 d . . .
C7 C 0.3836(3) 0.1231(5) 1.0474(6) 0.062(2) Uani 1 1 d . . .
H7 H 0.4010 0.0911 1.0969 0.075 Uiso 1 1 calc R . .
C8 C 0.4136(4) 0.1538(5) 1.0108(7) 0.063(2) Uani 1 1 d . B .
C9 C 0.3848(4) 0.2011(5) 0.9378(7) 0.069(3) Uani 1 1 d . . .
H9 H 0.4035 0.2255 0.9119 0.083 Uiso 1 1 calc R . .
C10 C 0.3286(4) 0.2123(4) 0.9029(6) 0.058(2) Uani 1 1 d . . .
H10 H 0.3101 0.2431 0.8522 0.069 Uiso 1 1 calc R . .
C11 C 0.3051(5) 0.0004(8) 1.2638(9) 0.117(5) Uani 1 1 d D . .
C12 C 0.2753(13) 0.014(2) 1.324(2) 0.133(8) Uani 0.485(12) 1 d PDU B 1
H12A H 0.2905 -0.0160 1.3788 0.200 Uiso 0.485(12) 1 calc PR B 1
H12B H 0.2361 0.0055 1.2857 0.200 Uiso 0.485(12) 1 calc PR B 1
H12C H 0.2810 0.0620 1.3452 0.200 Uiso 0.485(12) 1 calc PR B 1
C13 C 0.2851(16) -0.0736(13) 1.229(3) 0.156(9) Uani 0.485(12) 1 d PDU B 1
H13A H 0.2984 -0.1047 1.2823 0.234 Uiso 0.485(12) 1 calc PR B 1
H13B H 0.2992 -0.0883 1.1873 0.234 Uiso 0.485(12) 1 calc PR B 1
H13C H 0.2452 -0.0745 1.1942 0.234 Uiso 0.485(12) 1 calc PR B 1
C14 C 0.3646(9) 0.0137(19) 1.335(2) 0.122(7) Uani 0.485(12) 1 d PDU B 1
H14A H 0.3759 -0.0173 1.3883 0.182 Uiso 0.485(12) 1 calc PR B 1
H14B H 0.3689 0.0611 1.3565 0.182 Uiso 0.485(12) 1 calc PR B 1
H14C H 0.3873 0.0056 1.3058 0.182 Uiso 0.485(12) 1 calc PR B 1
C12' C 0.2607(11) -0.0316(19) 1.281(2) 0.133(8) Uani 0.515(12) 1 d PDU B 2
H12D H 0.2779 -0.0599 1.3379 0.200 Uiso 0.515(12) 1 calc PR B 2
H12E H 0.2365 -0.0601 1.2278 0.200 Uiso 0.515(12) 1 calc PR B 2
H12F H 0.2395 0.0048 1.2896 0.200 Uiso 0.515(12) 1 calc PR B 2
C13' C 0.3566(12) -0.0446(17) 1.284(3) 0.156(9) Uani 0.515(12) 1 d PDU B 2
H13D H 0.3675 -0.0722 1.3401 0.234 Uiso 0.515(12) 1 calc PR B 2
H13E H 0.3868 -0.0145 1.2933 0.234 Uiso 0.515(12) 1 calc PR B 2
H13F H 0.3474 -0.0747 1.2304 0.234 Uiso 0.515(12) 1 calc PR B 2
C14' C 0.3435(12) 0.0423(15) 1.3540(17) 0.122(7) Uani 0.515(12) 1 d PDU B 2
H14D H 0.3572 0.0125 1.4089 0.182 Uiso 0.515(12) 1 calc PR B 2
H14E H 0.3230 0.0803 1.3610 0.182 Uiso 0.515(12) 1 calc PR B 2
H14F H 0.3743 0.0605 1.3484 0.182 Uiso 0.515(12) 1 calc PR B 2
C15 C 0.4756(4) 0.1398(5) 1.0493(7) 0.077(3) Uani 1 1 d D . .
C16 C 0.4979(12) 0.0835(13) 1.1316(18) 0.104(6) Uani 0.485(12) 1 d PDU B 1
H16A H 0.4810 0.0392 1.1056 0.156 Uiso 0.485(12) 1 calc PR B 1
H16B H 0.4886 0.0975 1.1795 0.156 Uiso 0.485(12) 1 calc PR B 1
H16C H 0.5376 0.0797 1.1597 0.156 Uiso 0.485(12) 1 calc PR B 1
C17 C 0.4863(13) 0.1122(16) 0.9731(18) 0.105(6) Uani 0.485(12) 1 d PDU B 1
H17A H 0.4741 0.1457 0.9223 0.158 Uiso 0.485(12) 1 calc PR B 1
H17B H 0.4662 0.0693 0.9487 0.158 Uiso 0.485(12) 1 calc PR B 1
H17C H 0.5254 0.1038 0.9991 0.158 Uiso 0.485(12) 1 calc PR B 1
C18 C 0.5037(13) 0.2093(12) 1.094(2) 0.103(6) Uani 0.485(12) 1 d PDU B 1
H18A H 0.4905 0.2447 1.0451 0.154 Uiso 0.485(12) 1 calc PR B 1
H18B H 0.5433 0.2045 1.1210 0.154 Uiso 0.485(12) 1 calc PR B 1
H18C H 0.4949 0.2223 1.1425 0.154 Uiso 0.485(12) 1 calc PR B 1
C16' C 0.4883(11) 0.0649(10) 1.084(2) 0.104(6) Uani 0.515(12) 1 d PDU B 2
H16D H 0.4788 0.0346 1.0303 0.156 Uiso 0.515(12) 1 calc PR B 2
H16E H 0.4668 0.0523 1.1139 0.156 Uiso 0.515(12) 1 calc PR B 2
H16F H 0.5272 0.0604 1.1287 0.156 Uiso 0.515(12) 1 calc PR B 2
C17' C 0.4887(13) 0.1493(15) 0.9681(17) 0.105(6) Uani 0.515(12) 1 d PDU B 2
H17D H 0.4700 0.1901 0.9318 0.158 Uiso 0.515(12) 1 calc PR B 2
H17E H 0.4764 0.1091 0.9273 0.158 Uiso 0.515(12) 1 calc PR B 2
H17F H 0.5282 0.1549 0.9941 0.158 Uiso 0.515(12) 1 calc PR B 2
C18' C 0.5084(12) 0.1865(13) 1.1327(17) 0.103(6) Uani 0.515(12) 1 d PDU B 2
H18D H 0.5057 0.2338 1.1110 0.154 Uiso 0.515(12) 1 calc PR B 2
H18E H 0.5467 0.1723 1.1646 0.154 Uiso 0.515(12) 1 calc PR B 2
H18F H 0.4940 0.1836 1.1763 0.154 Uiso 0.515(12) 1 calc PR B 2
C19 C 0.0975(4) 0.1116(4) 0.5704(6) 0.061(2) Uani 1 1 d . . .
H19 H 0.0885 0.0649 0.5711 0.073 Uiso 1 1 calc R A .
C20 C 0.1327(4) 0.1430(4) 0.6539(6) 0.062(2) Uani 1 1 d . A .
H20 H 0.1450 0.1180 0.7103 0.075 Uiso 1 1 calc R . .
C21 C 0.1513(3) 0.2111(4) 0.6585(6) 0.055(2) Uani 1 1 d . . .
C22 C 0.1290(4) 0.2448(5) 0.5694(6) 0.071(3) Uani 1 1 d . A .
H22 H 0.1403 0.2900 0.5659 0.086 Uiso 1 1 calc R . .
C23 C 0.0913(4) 0.2120(6) 0.4891(7) 0.075(3) Uani 1 1 d . . .
H23 H 0.0758 0.2368 0.4321 0.090 Uiso 1 1 calc R A .
C24 C 0.0970(4) -0.0019(5) 0.8572(6) 0.062(2) Uani 1 1 d . . .
H24 H 0.1133 -0.0437 0.8546 0.074 Uiso 1 1 calc R . .
C25 C 0.1215(3) 0.0594(4) 0.8524(6) 0.057(2) Uani 1 1 d . . .
H25 H 0.1534 0.0582 0.8462 0.069 Uiso 1 1 calc R . .
C26 C 0.0989(3) 0.1222(4) 0.8566(5) 0.0522(19) Uani 1 1 d . . .
C27 C 0.0504(4) 0.1205(5) 0.8648(7) 0.071(2) Uani 1 1 d . . .
H27 H 0.0335 0.1618 0.8675 0.085 Uiso 1 1 calc R . .
C28 C 0.0280(4) 0.0567(5) 0.8687(7) 0.071(2) Uani 1 1 d . . .
H28 H -0.0042 0.0565 0.8738 0.085 Uiso 1 1 calc R . .
O5 O 0.5702(12) 0.0422(16) 0.824(2) 0.180(10) Uiso 0.50 1 d PD C -1
C29 C 0.6128(15) 0.068(2) 0.913(2) 0.153(13) Uiso 0.50 1 d PD C -1
O6 O 0.5315(15) 0.2042(18) 0.769(3) 0.224(16) Uiso 0.50 1 d PD D -1
C30 C 0.571(2) 0.154(3) 0.831(4) 0.21(2) Uiso 0.50 1 d PD D -1
O5' O 0.5862(15) 0.101(2) 0.872(3) 0.214(14) Uiso 0.50 1 d PD E 2
C29' C 0.5308(16) 0.099(3) 0.796(3) 0.181(16) Uiso 0.50 1 d PD . 2
O6' O 0.2802(17) 0.367(2) 0.555(3) 0.273(17) Uiso 0.50 1 d PD F 2
C30' C 0.302(2) 0.316(3) 0.634(4) 0.22(2) Uiso 0.50 1 d PD F 2
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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Zn Zn 0.2839 1.4301 '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
N1 Pt1 N2 78.2(3) . .
N1 Pt1 S1 174.16(19) . .
N2 Pt1 S1 96.2(2) . .
N1 Pt1 S2 98.09(19) . .
N2 Pt1 S2 175.72(19) . .
S1 Pt1 S2 87.51(9) . .
O4 Zn1 N3 116.4(3) . .
O4 Zn1 N4 106.9(3) . 6
N3 Zn1 N4 105.0(3) . 6
O4 Zn1 O1 115.1(5) . .
N3 Zn1 O1 115.9(6) . .
N4 Zn1 O1 93.7(6) 6 .
O4 Zn1 O1' 128.7(11) . .
N3 Zn1 O1' 102.6(11) . .
N4 Zn1 O1' 92.7(12) 6 .
O1 Zn1 O1' 14.3(11) . .
O4 Zn1 O2 90.7(6) . .
N3 Zn1 O2 91.4(6) . .
N4 Zn1 O2 146.5(6) 6 .
O1 Zn1 O2 52.8(8) . .
O1' Zn1 O2 54.8(13) . .
O4 Zn1 O2' 104.6(12) . .
N3 Zn1 O2' 79.0(12) . .
N4 Zn1 O2' 141.9(12) 6 .
O1 Zn1 O2' 53.1(13) . .
O1' Zn1 O2' 50.3(17) . .
O2 Zn1 O2' 15.6(11) . .
C21 S1 Pt1 110.1(3) . .
C26 S2 Pt1 108.2(3) . .
N5 O1 Zn1 109.8(14) . .
N5 O2 Zn1 84.3(11) . .
N5 O1' Zn1 101(3) . .
N5 O2' Zn1 79(2) . .
Zn1 O4 Zn1 126.2(5) 2 .
C5 N1 C1 117.4(7) . .
C5 N1 Pt1 116.0(5) . .
C1 N1 Pt1 126.6(5) . .
C10 N2 C6 118.0(7) . .
C10 N2 Pt1 126.7(6) . .
C6 N2 Pt1 115.3(5) . .
C19 N3 C23 116.5(7) . .
C19 N3 Zn1 120.4(6) . .
C23 N3 Zn1 123.0(6) . .
C28 N4 C24 116.0(8) . .
C28 N4 Zn1 124.5(6) . 6_556
C24 N4 Zn1 119.4(6) . 6_556
O1 N5 O3 140(2) . .
O1 N5 O1' 25(2) . .
O3 N5 O1' 134(3) . .
O1 N5 O2 112.1(16) . .
O3 N5 O2 106.8(19) . .
O1' N5 O2 116(2) . .
O1 N5 O3' 102(3) . .
O3 N5 O3' 38.3(17) . .
O1' N5 O3' 98(3) . .
O2 N5 O3' 145(3) . .
O1 N5 O2' 114(2) . .
O3 N5 O2' 104(2) . .
O1' N5 O2' 104(3) . .
O2 N5 O2' 30(2) . .
O3' N5 O2' 136(3) . .
C2 C1 N1 122.9(8) . .
C1 C2 C3 120.8(9) . .
C2 C3 C4 117.0(8) . .
C2 C3 C11 120.8(9) . .
C4 C3 C11 122.0(9) . .
C5 C4 C3 119.8(8) . .
N1 C5 C4 121.9(7) . .
N1 C5 C6 113.8(7) . .
C4 C5 C6 124.2(7) . .
N2 C6 C7 121.1(7) . .
N2 C6 C5 115.5(7) . .
C7 C6 C5 123.3(7) . .
C8 C7 C6 121.7(8) . .
C7 C8 C9 115.6(8) . .
C7 C8 C15 122.9(9) . .
C9 C8 C15 121.4(9) . .
C10 C9 C8 120.7(9) . .
N2 C10 C9 122.7(9) . .
C14 C11 C12' 128(2) . .
C14 C11 C13 120(2) . .
C12' C11 C13 61.0(19) . .
C14 C11 C14' 36.6(15) . .
C12' C11 C14' 106(2) . .
C13 C11 C14' 142(2) . .
C14 C11 C13' 52.1(17) . .
C12' C11 C13' 118(2) . .
C13 C11 C13' 72(2) . .
C14' C11 C13' 87.5(19) . .
C14 C11 C3 113.2(15) . .
C12' C11 C3 115.1(15) . .
C13 C11 C3 107.3(17) . .
C14' C11 C3 109.9(15) . .
C13' C11 C3 115.0(16) . .
C14 C11 C12 102(2) . .
C12' C11 C12 40.4(15) . .
C13 C11 C12 101(2) . .
C14' C11 C12 69.8(18) . .
C13' C11 C12 131.9(19) . .
C3 C11 C12 112.6(16) . .
C17 C15 C18' 132.3(19) . .
C17 C15 C16' 82.0(16) . .
C18' C15 C16' 108.1(17) . .
C17 C15 C17' 27.7(15) . .
C18' C15 C17' 113.7(18) . .
C16' C15 C17' 108.4(16) . .
C17 C15 C8 111.2(14) . .
C18' C15 C8 108.9(14) . .
C16' C15 C8 109.1(13) . .
C17' C15 C8 108.6(14) . .
C17 C15 C18 115.6(19) . .
C18' C15 C18 27.6(15) . .
C16' C15 C18 132.9(18) . .
C17' C15 C18 90.9(17) . .
C8 C15 C18 104.2(14) . .
C17 C15 C16 107.0(17) . .
C18' C15 C16 80.9(16) . .
C16' C15 C16 28.6(14) . .
C17' C15 C16 129.8(17) . .
C8 C15 C16 111.0(13) . .
C18 C15 C16 107.7(18) . .
N3 C19 C20 122.3(8) . .
C19 C20 C21 122.5(8) . .
C20 C21 C22 114.2(7) . .
C20 C21 S1 127.0(6) . .
C22 C21 S1 118.7(7) . .
C23 C22 C21 120.3(9) . .
N3 C23 C22 123.9(8) . .
N4 C24 C25 123.9(8) . .
C26 C25 C24 119.9(8) . .
C25 C26 C27 117.3(8) . .
C25 C26 S2 126.1(6) . .
C27 C26 S2 116.6(7) . .
C28 C27 C26 119.3(9) . .
N4 C28 C27 123.5(9) . .
O5' C29' C29' 176(6) . 2_656
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pt1 N1 2.052(6) .
Pt1 N2 2.060(7) .
Pt1 S1 2.285(2) .
Pt1 S2 2.288(2) .
Zn1 O4 1.901(4) .
Zn1 N3 2.007(7) .
Zn1 N4 2.021(7) 6
Zn1 O1 2.034(19) .
Zn1 O1' 2.14(4) .
Zn1 O2 2.45(2) .
Zn1 O2' 2.55(5) .
S1 C21 1.718(8) .
S2 C26 1.744(8) .
O1 N5 1.15(2) .
O2 N5 1.29(2) .
O3 N5 1.153(18) .
O1' N5 1.23(4) .
O2' N5 1.35(5) .
O3' N5 1.35(4) .
O4 Zn1 1.901(4) 2
N1 C5 1.344(10) .
N1 C1 1.346(10) .
N2 C10 1.319(11) .
N2 C6 1.335(10) .
N3 C19 1.341(10) .
N3 C23 1.345(12) .
N4 C28 1.344(11) .
N4 C24 1.356(11) .
N4 Zn1 2.021(7) 6_556
C1 C2 1.344(12) .
C2 C3 1.372(13) .
C3 C4 1.388(13) .
C3 C11 1.567(14) .
C4 C5 1.376(11) .
C5 C6 1.474(11) .
C6 C7 1.395(11) .
C7 C8 1.359(12) .
C8 C9 1.384(14) .
C8 C15 1.529(12) .
C9 C10 1.380(13) .
C11 C14 1.491(18) .
C11 C12' 1.513(17) .
C11 C13 1.526(18) .
C11 C14' 1.538(18) .
C11 C13' 1.552(18) .
C11 C12 1.572(18) .
C15 C17 1.488(17) .
C15 C18' 1.494(17) .
C15 C16' 1.515(17) .
C15 C17' 1.526(17) .
C15 C18 1.531(17) .
C15 C16 1.579(17) .
C19 C20 1.351(11) .
C20 C21 1.390(12) .
C21 C22 1.408(11) .
C22 C23 1.352(13) .
C24 C25 1.376(12) .
C25 C26 1.372(11) .
C26 C27 1.406(12) .
C27 C28 1.385(13) .
O5 C29 1.421(19) .
O6 C30 1.43(2) .
O5' C29' 1.412(19) .
C29' C29' 1.61(7) 2_656
O6' C30' 1.47(2) .
