#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/13/7101344.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_7101344
loop_
_publ_author_name
V.Yam
K.Man-Chung
'Nianyong Zhu'
_publ_section_title
;
Unprecedented formation of an acetamidate-bridged dinuclear
platinum(II) terpyridyl complex--correlation of luminescence properties
with the crystal forms and dimerization studies in solution
;
_journal_issue                   32
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b606352g
_journal_year                    2006
_chemical_formula_moiety         'C39.50 H35 F9 N7 O11.50 Pt2 S3'
_chemical_formula_sum            'C39.5 H35 F9 N7 O11.5 Pt2 S3'
_chemical_formula_weight         1449.11
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                105.61(3)
_cell_angle_beta                 106.55(3)
_cell_angle_gamma                98.27(3)
_cell_formula_units_Z            2
_cell_length_a                   13.743(3)
_cell_length_b                   13.814(3)
_cell_length_c                   13.969(3)
_cell_measurement_reflns_used    0
_cell_measurement_temperature    301(2)
_cell_measurement_theta_max      0
_cell_measurement_theta_min      0
_cell_volume                     2377.5(9)
_computing_cell_refinement       scalepack
_computing_data_collection       marcontrol
_computing_data_reduction        denzo
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    SIR-97
_diffrn_ambient_temperature      301(2)
_diffrn_measured_fraction_theta_full 0.928
_diffrn_measured_fraction_theta_max 0.928
_diffrn_measurement_device_type  'marresearch IPDS mar300'
_diffrn_measurement_method       oscillation
_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  0.0376
_diffrn_reflns_av_sigmaI/netI    0.0594
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            17972
_diffrn_reflns_theta_full        25.63
_diffrn_reflns_theta_max         25.63
_diffrn_reflns_theta_min         1.58
_exptl_absorpt_coefficient_mu    6.111
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            'orange red'
_exptl_crystal_density_diffrn    2.024
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1396
_exptl_crystal_size_max          0.4
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.901
_refine_diff_density_min         -3.382
_refine_diff_density_rms         0.394
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.100
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     648
_refine_ls_number_reflns         8328
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.100
_refine_ls_R_factor_all          0.0505
_refine_ls_R_factor_gt           0.0390
_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)+(0.0703P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1092
_refine_ls_wR_factor_ref         0.1236
_reflns_number_gt                6627
_reflns_number_total             8328
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b606352g.txt
_cod_original_formula_sum        'C39.50 H35 F9 N7 O11.50 Pt2 S3'
_cod_database_code               7101344
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Pt1 Pt 0.17266(2) 0.02136(2) 0.55807(2) 0.04243(10) Uani 1 1 d .
Pt2 Pt 0.36812(2) 0.02079(2) 0.48687(2) 0.04419(11) Uani 1 1 d .
O1 O 0.4119(5) 0.1640(4) 0.5956(5) 0.0635(15) Uani 1 1 d .
N1 N 0.1111(5) 0.0415(5) 0.4166(5) 0.0486(15) Uani 1 1 d .
N2 N 0.0955(5) -0.1195(5) 0.4769(5) 0.0443(14) Uani 1 1 d .
N3 N 0.2003(5) -0.0432(5) 0.6748(5) 0.0481(15) Uani 1 1 d .
N4 N 0.3309(5) 0.0651(5) 0.3575(5) 0.0517(16) Uani 1 1 d .
N5 N 0.3279(4) -0.1132(4) 0.3811(4) 0.0417(13) Uani 1 1 d .
N6 N 0.3998(5) -0.0649(5) 0.5840(5) 0.0461(14) Uani 1 1 d .
N7 N 0.2648(5) 0.1676(5) 0.6427(5) 0.0544(16) Uani 1 1 d .
H7A H 0.2684 0.1763 0.7099 0.065 Uiso 1 1 calc R
C1 C 0.1156(6) 0.1319(6) 0.3957(7) 0.0529(19) Uani 1 1 d .
H1 H 0.1500 0.1940 0.4501 0.064 Uiso 1 1 calc R
C2 C 0.0702(7) 0.1327(8) 0.2956(8) 0.062(2) Uani 1 1 d .
H2 H 0.0747 0.1953 0.2821 0.075 Uiso 1 1 calc R
C3 C 0.0182(8) 0.0423(8) 0.2148(7) 0.067(2) Uani 1 1 d .
H3 H -0.0125 0.0430 0.1465 0.081 Uiso 1 1 calc R
C4 C 0.0115(6) -0.0505(7) 0.2359(6) 0.0564(19) Uani 1 1 d .
H4 H -0.0240 -0.1125 0.1817 0.068 Uiso 1 1 calc R
C5 C 0.0578(5) -0.0506(6) 0.3372(6) 0.0495(17) Uani 1 1 d .
C6 C 0.0552(6) -0.1427(6) 0.3692(6) 0.0503(18) Uani 1 1 d .
C7 C 0.0194(7) -0.2449(6) 0.3073(7) 0.062(2) Uani 1 1 d .
H7 H -0.0067 -0.2631 0.2340 0.074 Uiso 1 1 calc R
C8 C 0.0230(8) -0.3208(7) 0.3559(8) 0.075(3) Uani 1 1 d .
H8 H -0.0037 -0.3900 0.3142 0.090 Uiso 1 1 calc R
C9 C 0.0655(6) -0.2959(6) 0.4657(7) 0.063(2) Uani 1 1 d .
H9 H 0.0687 -0.3471 0.4974 0.075 Uiso 1 1 calc R
C10 C 0.1025(6) -0.1925(6) 0.5250(6) 0.0476(17) Uani 1 1 d .
C11 C 0.1555(6) -0.1457(6) 0.6414(6) 0.0507(19) Uani 1 1 d .
C12 C 0.1601(7) -0.2001(7) 0.7105(7) 0.059(2) Uani 1 1 d .
H12 H 0.1280 -0.2704 0.6862 0.071 Uiso 1 1 calc R
C13 C 0.2134(8) -0.1491(9) 0.8176(8) 0.075(3) Uani 1 1 d .
H13 H 0.2180 -0.1850 0.8656 0.090 Uiso 1 1 calc R
C14 C 0.2590(7) -0.0459(8) 0.8516(7) 0.069(2) Uani 1 1 d .
H14 H 0.2950 -0.0110 0.9230 0.083 Uiso 1 1 calc R
C15 C 0.2516(6) 0.0066(7) 0.7793(6) 0.0537(19) Uani 1 1 d .
H15 H 0.2822 0.0771 0.8028 0.064 Uiso 1 1 calc R
C16 C 0.3364(7) 0.1606(7) 0.3517(8) 0.061(2) Uani 1 1 d .
H16 H 0.3622 0.2168 0.4138 0.073 Uiso 1 1 calc R
C17 C 0.3051(8) 0.1780(8) 0.2565(8) 0.071(3) Uani 1 1 d .
H17 H 0.3091 0.2453 0.2547 0.085 Uiso 1 1 calc R
C18 C 0.2687(8) 0.0974(9) 0.1659(8) 0.076(3) Uani 1 1 d .
H18 H 0.2467 0.1091 0.1014 0.091 Uiso 1 1 calc R
C19 C 0.2638(6) -0.0024(7) 0.1683(7) 0.061(2) Uani 1 1 d .
H19 H 0.2399 -0.0579 0.1057 0.073 Uiso 1 1 calc R
C20 C 0.2948(6) -0.0191(6) 0.2650(6) 0.0514(18) Uani 1 1 d .
C21 C 0.2917(6) -0.1197(6) 0.2789(6) 0.0484(17) Uani 1 1 d .
C22 C 0.2548(7) -0.2163(7) 0.2024(7) 0.066(2) Uani 1 1 d .
H22 H 0.2306 -0.2230 0.1311 0.079 Uiso 1 1 calc R
C23 C 0.2544(8) -0.3030(7) 0.2343(7) 0.073(2) Uani 1 1 d .
H23 H 0.2293 -0.3684 0.1834 0.088 Uiso 1 1 calc R
C24 C 0.2905(7) -0.2948(6) 0.3398(7) 0.064(2) Uani 1 1 d .
H24 H 0.2892 -0.3537 0.3600 0.077 Uiso 1 1 calc R
C25 C 0.3286(6) -0.1970(6) 0.4150(6) 0.0515(18) Uani 1 1 d .
C26 C 0.3687(6) -0.1680(6) 0.5309(6) 0.0468(17) Uani 1 1 d .
C27 C 0.3788(6) -0.2386(7) 0.5856(6) 0.0569(19) Uani 1 1 d .
H27 H 0.3562 -0.3094 0.5494 0.068 Uiso 1 1 calc R
C28 C 0.4230(7) -0.2021(7) 0.6948(7) 0.063(2) Uani 1 1 d .
H28 H 0.4299 -0.2484 0.7325 0.075 Uiso 1 1 calc R
C29 C 0.4563(7) -0.0989(7) 0.7465(7) 0.057(2) Uani 1 1 d .
H29 H 0.4872 -0.0740 0.8197 0.069 Uiso 1 1 calc R
C30 C 0.4440(6) -0.0301(6) 0.6896(6) 0.0490(18) Uani 1 1 d .
H30 H 0.4666 0.0408 0.7252 0.059 Uiso 1 1 calc R
C31 C 0.3585(6) 0.2077(5) 0.6492(6) 0.0500(18) Uani 1 1 d .
C32 C 0.4135(8) 0.3154(6) 0.7233(7) 0.076(3) Uani 1 1 d .
H32A H 0.4841 0.3166 0.7615 0.114 Uiso 1 1 calc R
H32B H 0.3775 0.3361 0.7723 0.114 Uiso 1 1 calc R
H32C H 0.4139 0.3623 0.6836 0.114 Uiso 1 1 calc R
S1 S 0.00415(19) 0.2574(2) 0.04291(18) 0.0701(6) Uani 1 1 d .
S2 S 0.53622(18) 0.18175(18) 0.97079(17) 0.0656(6) Uani 1 1 d .
S3 S 0.1920(2) 0.4350(2) 0.4704(2) 0.0762(7) Uani 1 1 d .
F1 F -0.0241(10) 0.3839(8) 0.1987(8) 0.195(5) Uani 1 1 d .
F2 F -0.0910(14) 0.4009(12) 0.0426(12) 0.244(7) Uani 1 1 d .
F3 F 0.0762(12) 0.4527(8) 0.1343(9) 0.223(6) Uani 1 1 d .
F4 F 0.6778(7) 0.3384(6) 1.1142(7) 0.161(4) Uani 1 1 d .
F5 F 0.5440(7) 0.3777(6) 1.0406(8) 0.137(3) Uani 1 1 d .
F6 F 0.6446(7) 0.3436(6) 0.9585(8) 0.151(3) Uani 1 1 d .
F7 F 0.2052(6) 0.4122(7) 0.6529(6) 0.125(2) Uani 1 1 d .
F8 F 0.1677(10) 0.5508(8) 0.6356(7) 0.182(5) Uani 1 1 d .
F9 F 0.3246(7) 0.5334(7) 0.6604(7) 0.139(3) Uani 1 1 d .
C33 C -0.0029(13) 0.3831(12) 0.1125(10) 0.114(4) Uani 1 1 d .
C34 C 0.6032(10) 0.3181(9) 1.0274(9) 0.088(3) Uani 1 1 d .
C35 C 0.2236(10) 0.4878(10) 0.6116(10) 0.094(3) Uani 1 1 d .
O2 O 0.0935(9) 0.2444(11) 0.1170(9) 0.163(5) Uani 1 1 d .
O3 O -0.0937(7) 0.1935(8) 0.0290(7) 0.137(4) Uani 1 1 d .
O4 O 0.0178(8) 0.2692(7) -0.0498(6) 0.106(3) Uani 1 1 d .
O5 O 0.4975(8) 0.1664(7) 1.0512(7) 0.118(3) Uani 1 1 d .
O6 O 0.4588(6) 0.1764(6) 0.8774(5) 0.096(2) Uani 1 1 d .
O7 O 0.6135(6) 0.1274(6) 0.9544(7) 0.107(3) Uani 1 1 d .
O8 O 0.2593(7) 0.3644(6) 0.4631(8) 0.113(3) Uani 1 1 d .
O9 O 0.0852(6) 0.3858(7) 0.4308(7) 0.119(3) Uani 1 1 d .
O10 O 0.2255(7) 0.5248(6) 0.4442(7) 0.106(3) Uani 1 1 d .
O11 O 0.2144(7) 0.2504(8) 0.8344(8) 0.125(3) Uani 1 1 d .
C36 C 0.2542(18) 0.4178(12) 0.9420(16) 0.220(12) Uani 1 1 d .
H36A H 0.2216 0.4258 0.8750 0.330 Uiso 1 1 calc R
H36B H 0.3257 0.4567 0.9714 0.330 Uiso 1 1 calc R
H36C H 0.2177 0.4427 0.9892 0.330 Uiso 1 1 calc R
C37 C 0.2509(10) 0.3125(11) 0.9282(11) 0.102(4) Uani 1 1 d .
C38 C 0.2984(15) 0.2915(18) 1.0226(15) 0.201(12) Uani 1 1 d .
H38A H 0.2947 0.2187 1.0065 0.301 Uiso 1 1 calc R
H38B H 0.2623 0.3123 1.0714 0.301 Uiso 1 1 calc R
H38C H 0.3702 0.3293 1.0536 0.301 Uiso 1 1 calc R
O12 O 0.5111(18) 0.377(2) 0.5377(19) 0.155(8) Uiso 0.50 1 d P
C39 C 0.559(3) 0.544(3) 0.645(3) 0.158(13) Uiso 0.50 1 d P
C40 C 0.525(2) 0.469(3) 0.558(3) 0.105(8) Uiso 0.50 1 d P
C41 C 0.491(3) 0.471(4) 0.464(3) 0.153(14) Uiso 0.50 1 d P
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Pt Pt 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
C C 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 '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
N2 Pt1 N1 81.5(3) . .
N2 Pt1 N3 80.4(3) . .
N1 Pt1 N3 161.5(3) . .
N2 Pt1 N7 175.5(2) . .
N1 Pt1 N7 99.2(3) . .
N3 Pt1 N7 99.1(3) . .
N2 Pt1 Pt2 98.70(17) . .
N1 Pt1 Pt2 81.58(16) . .
N3 Pt1 Pt2 104.87(17) . .
N7 Pt1 Pt2 77.10(19) . .
N5 Pt2 N4 81.4(3) . .
N5 Pt2 O1 178.3(2) . .
N4 Pt2 O1 97.1(3) . .
N5 Pt2 N6 81.6(2) . .
N4 Pt2 N6 162.8(3) . .
O1 Pt2 N6 99.8(2) . .
N5 Pt2 Pt1 101.48(15) . .
N4 Pt2 Pt1 104.55(18) . .
O1 Pt2 Pt1 79.70(16) . .
N6 Pt2 Pt1 81.43(16) . .
C31 O1 Pt2 127.5(5) . .
C1 N1 C5 120.1(7) . .
C1 N1 Pt1 127.6(5) . .
C5 N1 Pt1 112.3(5) . .
C10 N2 C6 123.3(7) . .
C10 N2 Pt1 118.6(5) . .
C6 N2 Pt1 116.7(5) . .
C11 N3 C15 119.1(7) . .
C11 N3 Pt1 113.8(5) . .
C15 N3 Pt1 126.9(6) . .
C16 N4 C20 119.4(7) . .
C16 N4 Pt2 128.8(6) . .
C20 N4 Pt2 111.8(5) . .
C21 N5 C25 123.8(6) . .
C21 N5 Pt2 118.5(5) . .
C25 N5 Pt2 117.4(5) . .
C30 N6 C26 120.3(7) . .
C30 N6 Pt2 127.2(5) . .
C26 N6 Pt2 112.5(5) . .
C31 N7 Pt1 129.5(5) . .
C31 N7 H7A 104.9 . .
Pt1 N7 H7A 104.9 . .
N1 C1 C2 120.6(8) . .
N1 C1 H1 119.7 . .
C2 C1 H1 119.7 . .
C1 C2 C3 120.6(8) . .
C1 C2 H2 119.7 . .
C3 C2 H2 119.7 . .
C2 C3 C4 119.2(8) . .
C2 C3 H3 120.4 . .
C4 C3 H3 120.4 . .
C5 C4 C3 119.8(8) . .
C5 C4 H4 120.1 . .
C3 C4 H4 120.1 . .
C4 C5 N1 119.7(7) . .
C4 C5 C6 124.9(7) . .
N1 C5 C6 115.5(7) . .
C7 C6 N2 118.4(7) . .
C7 C6 C5 128.9(7) . .
N2 C6 C5 112.7(7) . .
C6 C7 C8 119.0(8) . .
C6 C7 H7 120.5 . .
C8 C7 H7 120.5 . .
C7 C8 C9 121.9(8) . .
C7 C8 H8 119.1 . .
C9 C8 H8 119.1 . .
C10 C9 C8 117.4(8) . .
C10 C9 H9 121.3 . .
C8 C9 H9 121.3 . .
N2 C10 C9 120.0(7) . .
N2 C10 C11 111.8(7) . .
C9 C10 C11 128.2(7) . .
N3 C11 C12 121.7(8) . .
N3 C11 C10 114.5(7) . .
C12 C11 C10 123.8(8) . .
C11 C12 C13 119.1(9) . .
C11 C12 H12 120.5 . .
C13 C12 H12 120.5 . .
C14 C13 C12 119.4(8) . .
C14 C13 H13 120.3 . .
C12 C13 H13 120.3 . .
C13 C14 C15 119.7(9) . .
C13 C14 H14 120.1 . .
C15 C14 H14 120.1 . .
N3 C15 C14 120.9(9) . .
N3 C15 H15 119.5 . .
C14 C15 H15 119.5 . .
N4 C16 C17 121.8(9) . .
N4 C16 H16 119.1 . .
C17 C16 H16 119.1 . .
C18 C17 C16 119.7(9) . .
C18 C17 H17 120.1 . .
C16 C17 H17 120.1 . .
C17 C18 C19 120.3(8) . .
C17 C18 H18 119.9 . .
C19 C18 H18 119.9 . .
C18 C19 C20 119.5(9) . .
C18 C19 H19 120.3 . .
C20 C19 H19 120.3 . .
C19 C20 N4 119.2(7) . .
C19 C20 C21 125.2(8) . .
N4 C20 C21 115.6(7) . .
N5 C21 C22 119.0(7) . .
N5 C21 C20 112.6(6) . .
C22 C21 C20 128.4(7) . .
C21 C22 C23 118.6(8) . .
C21 C22 H22 120.7 . .
C23 C22 H22 120.7 . .
C24 C23 C22 121.6(8) . .
C24 C23 H23 119.2 . .
C22 C23 H23 119.2 . .
C23 C24 C25 118.7(8) . .
C23 C24 H24 120.6 . .
C25 C24 H24 120.6 . .
N5 C25 C24 118.3(7) . .
N5 C25 C26 112.7(7) . .
C24 C25 C26 129.1(7) . .
N6 C26 C27 120.3(7) . .
N6 C26 C25 115.4(7) . .
C27 C26 C25 124.2(7) . .
C28 C27 C26 119.1(8) . .
C28 C27 H27 120.4 . .
C26 C27 H27 120.4 . .
C29 C28 C27 119.8(8) . .
C29 C28 H28 120.1 . .
C27 C28 H28 120.1 . .
C28 C29 C30 119.7(8) . .
C28 C29 H29 120.1 . .
C30 C29 H29 120.1 . .
N6 C30 C29 120.7(8) . .
N6 C30 H30 119.6 . .
C29 C30 H30 119.6 . .
O1 C31 N7 125.9(7) . .
O1 C31 C32 114.3(7) . .
N7 C31 C32 119.7(8) . .
C31 C32 H32A 109.5 . .
C31 C32 H32B 109.5 . .
H32A C32 H32B 109.5 . .
C31 C32 H32C 109.5 . .
H32A C32 H32C 109.5 . .
H32B C32 H32C 109.5 . .
O4 S1 O3 115.7(6) . .
O4 S1 O2 115.7(6) . .
O3 S1 O2 115.2(7) . .
O4 S1 C33 103.0(6) . .
O3 S1 C33 103.2(7) . .
O2 S1 C33 100.9(8) . .
O6 S2 O7 114.3(5) . .
O6 S2 O5 114.5(6) . .
O7 S2 O5 114.8(6) . .
O6 S2 C34 103.5(5) . .
O7 S2 C34 105.9(5) . .
O5 S2 C34 101.7(6) . .
O9 S3 O10 118.9(6) . .
O9 S3 O8 113.7(6) . .
O10 S3 O8 112.8(5) . .
O9 S3 C35 105.2(5) . .
O10 S3 C35 102.1(5) . .
O8 S3 C35 101.4(5) . .
F3 C33 F1 110.0(13) . .
F3 C33 F2 110.0(15) . .
F1 C33 F2 107.1(14) . .
F3 C33 S1 114.4(13) . .
F1 C33 S1 111.1(11) . .
F2 C33 S1 103.8(10) . .
F5 C34 F4 109.2(11) . .
F5 C34 F6 104.8(11) . .
F4 C34 F6 107.5(12) . .
F5 C34 S2 114.0(9) . .
F4 C34 S2 112.7(9) . .
F6 C34 S2 108.2(8) . .
F8 C35 F9 110.3(13) . .
F8 C35 F7 106.7(11) . .
F9 C35 F7 105.1(10) . .
F8 C35 S3 111.6(9) . .
F9 C35 S3 111.8(9) . .
F7 C35 S3 111.0(9) . .
C37 C36 H36A 109.5 . .
C37 C36 H36B 109.5 . .
H36A C36 H36B 109.5 . .
C37 C36 H36C 109.5 . .
H36A C36 H36C 109.5 . .
H36B C36 H36C 109.5 . .
O11 C37 C36 117.1(16) . .
O11 C37 C38 128.2(16) . .
C36 C37 C38 114.4(16) . .
C37 C38 H38A 109.5 . .
C37 C38 H38B 109.5 . .
H38A C38 H38B 109.5 . .
C37 C38 H38C 109.5 . .
H38A C38 H38C 109.5 . .
H38B C38 H38C 109.5 . .
C40 O12 C41 42.4(18) . .
C40 C39 C41 43(2) . 2_666
C41 C40 O12 149(5) 2_666 .
C41 C40 C41 53(4) 2_666 .
O12 C40 C41 98(4) . .
C41 C40 C39 77(4) 2_666 .
O12 C40 C39 133(4) . .
C41 C40 C39 129(5) . .
C41 C40 C40 30(3) 2_666 2_666
O12 C40 C40 120(3) . 2_666
C41 C40 C40 23(2) . 2_666
C39 C40 C40 107(4) . 2_666
C40 C41 C41 78(6) 2_666 2_666
C40 C41 C40 127(4) 2_666 .
C41 C41 C40 50(4) 2_666 .
C40 C41 C39 60(4) 2_666 2_666
C41 C41 C39 137(8) 2_666 2_666
C40 C41 C39 170(5) . 2_666
C40 C41 O12 164(4) 2_666 .
C41 C41 O12 89(6) 2_666 .
C40 C41 O12 40(3) . .
C39 C41 O12 131(3) 2_666 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pt1 N2 1.932(6) .
Pt1 N1 2.027(6) .
Pt1 N3 2.032(6) .
Pt1 N7 2.052(6) .
Pt1 Pt2 3.1191(8) .
Pt2 N5 1.919(6) .
Pt2 N4 2.015(7) .
Pt2 O1 2.025(6) .
Pt2 N6 2.027(6) .
O1 C31 1.289(9) .
N1 C1 1.354(10) .
N1 C5 1.377(10) .
N2 C10 1.353(9) .
N2 C6 1.375(9) .
N3 C11 1.353(10) .
N3 C15 1.354(10) .
N4 C16 1.335(10) .
N4 C20 1.389(10) .
N5 C21 1.344(9) .
N5 C25 1.364(9) .
N6 C30 1.342(10) .
N6 C26 1.355(9) .
N7 C31 1.294(9) .
N7 H7A 0.9000 .
C1 C2 1.363(12) .
C1 H1 0.9300 .
C2 C3 1.368(13) .
C2 H2 0.9300 .
C3 C4 1.387(12) .
C3 H3 0.9300 .
C4 C5 1.377(11) .
C4 H4 0.9300 .
C5 C6 1.457(10) .
C6 C7 1.372(11) .
C7 C8 1.394(12) .
C7 H7 0.9300 .
C8 C9 1.401(13) .
C8 H8 0.9300 .
C9 C10 1.379(11) .
C9 H9 0.9300 .
C10 C11 1.488(11) .
C11 C12 1.368(11) .
C12 C13 1.390(13) .
C12 H12 0.9300 .
C13 C14 1.363(14) .
C13 H13 0.9300 .
C14 C15 1.382(12) .
C14 H14 0.9300 .
C15 H15 0.9300 .
C16 C17 1.374(13) .
C16 H16 0.9300 .
C17 C18 1.346(14) .
C17 H17 0.9300 .
C18 C19 1.381(13) .
C18 H18 0.9300 .
C19 C20 1.389(11) .
C19 H19 0.9300 .
C20 C21 1.450(11) .
C21 C22 1.381(11) .
C22 C23 1.386(12) .
C22 H22 0.9300 .
C23 C24 1.381(12) .
C23 H23 0.9300 .
C24 C25 1.386(11) .
C24 H24 0.9300 .
C25 C26 1.471(10) .
C26 C27 1.392(11) .
C27 C28 1.386(12) .
C27 H27 0.9300 .
C28 C29 1.354(13) .
C28 H28 0.9300 .
C29 C30 1.392(12) .
C29 H29 0.9300 .
C30 H30 0.9300 .
C31 C32 1.503(11) .
C32 H32A 0.9600 .
C32 H32B 0.9600 .
C32 H32C 0.9600 .
S1 O4 1.408(7) .
S1 O3 1.429(8) .
S1 O2 1.431(9) .
S1 C33 1.779(15) .
S2 O6 1.405(7) .
S2 O7 1.421(7) .
S2 O5 1.424(8) .
S2 C34 1.818(12) .
S3 O9 1.404(8) .
S3 O10 1.435(8) .
S3 O8 1.441(7) .
S3 C35 1.805(13) .
F1 C33 1.314(15) .
F2 C33 1.422(18) .
F3 C33 1.247(16) .
F4 C34 1.275(13) .
F5 C34 1.254(13) .
F6 C34 1.346(14) .
F7 C35 1.348(12) .
F8 C35 1.281(12) .
F9 C35 1.329(14) .
O11 C37 1.265(14) .
C36 C37 1.407(19) .
C36 H36A 0.9600 .
C36 H36B 0.9600 .
C36 H36C 0.9600 .
C37 C38 1.42(2) .
C38 H38A 0.9600 .
C38 H38B 0.9600 .
C38 H38C 0.9600 .
O12 C40 1.20(3) .
O12 C41 1.86(6) .
C39 C40 1.27(5) .
C39 C41 1.42(6) 2_666
C40 C41 0.99(5) 2_666
C40 C41 1.27(5) .
C40 C40 2.03(6) 2_666
C41 C40 0.99(5) 2_666
C41 C41 1.03(8) 2_666
C41 C39 1.42(6) 2_666
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
N2 Pt1 Pt2 N5 5.6(2)
N1 Pt1 Pt2 N4 9.6(3)
N3 Pt1 Pt2 N6 8.4(2)
