# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2016

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_2a
_database_code_depnum_ccdc_archive 'CCDC 1438721'
_audit_update_record             
;
2015-11-25 deposited with the CCDC.
2016-02-22 downloaded from the CCDC.
;
#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C44 H48 Ag2 Cl4 N10 Pt2'
_chemical_formula_moiety         'C44 H48 Ag2 Cl4 N10 Pt2'
_chemical_formula_weight         1464.66
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_Int_Tables_number      2
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +X,+Y,+Z
2 -X,-Y,-Z
#------------------------------------------------------------------------------
_cell_length_a                   9.481(2)
_cell_length_b                   11.831(3)
_cell_length_c                   12.311(4)
_cell_angle_alpha                114.5444(19)
_cell_angle_beta                 103.778(3)
_cell_angle_gamma                100.7253(17)
_cell_volume                     1154.8(5)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    4422
_cell_measurement_theta_min      3.05
_cell_measurement_theta_max      27.49
_cell_measurement_temperature    93
#------------------------------------------------------------------------------
_exptl_crystal_description       prism
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.240
_exptl_crystal_size_mid          0.220
_exptl_crystal_size_min          0.180
_exptl_crystal_density_diffrn    2.106
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             700.00
_exptl_absorpt_coefficient_mu    7.123
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_absorpt_correction_T_min  0.224
_exptl_absorpt_correction_T_max  0.277

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      93
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku Saturn724'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 7.111
_diffrn_reflns_number            14397
_diffrn_reflns_av_R_equivalents  0.0329
_diffrn_reflns_av_sigmaI/netI    0.0453
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_full        27.47
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measured_fraction_theta_full 0.996
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       15
_diffrn_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             5272
_reflns_number_gt                4738
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0181
_refine_ls_wR_factor_ref         0.0355
_refine_ls_number_restraints     12
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         5272
_refine_ls_number_parameters     284
_refine_ls_goodness_of_fit_ref   0.909
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0069P)²+0.0000P] 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          0.002
_refine_diff_density_max         0.860
_refine_diff_density_min         -0.690
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
H H 0.0000 0.0000
;
International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.4)
;
N N 0.0061 0.0033
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Pt Pt -1.7033 8.3905
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Cl Cl 0.1484 0.1585
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
C C 0.0033 0.0016
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Ag Ag -0.8971 1.1015
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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 0.632442(12) 0.285568(11) 0.099434(10) 0.01232(4) Uani 1.0 2 d . . .
Ag1 Ag 0.37245(2) 0.03238(2) 0.06028(2) 0.01771(6) Uani 1.0 2 d . . .
Cl1 Cl 0.70740(11) -0.00160(9) 0.35244(10) 0.0522(3) Uani 1.0 2 d . . .
Cl2 Cl 0.99614(10) 0.19121(9) 0.54403(9) 0.0443(3) Uani 1.0 2 d . . .
N11 N 0.6575(3) 0.2750(3) -0.0608(3) 0.0151(6) Uani 0.5000 2 d . . .
N21 N 0.4450(3) 0.3266(3) 0.0335(3) 0.0142(6) Uani 0.5000 2 d . . .
N31 N 0.5897(3) 0.2959(3) 0.2586(2) 0.0133(6) Uani 1.0 2 d . . .
N32 N 0.4949(3) 0.1845(3) 0.2468(2) 0.0150(6) Uani 1.0 2 d . . .
N41 N 0.8242(3) 0.2381(3) 0.1532(2) 0.0138(6) Uani 1.0 2 d . . .
N42 N 0.8085(3) 0.1076(3) 0.1089(2) 0.0151(6) Uani 1.0 2 d . . .
C1 C 0.8328(4) 0.1573(3) 0.4167(3) 0.0261(8) Uani 1.0 2 d . . .
C11 C 0.6575(3) 0.2750(3) -0.0608(3) 0.0151(6) Uani 0.5000 2 d . . .
C12 C 0.5424(4) 0.2975(3) -0.1347(3) 0.0158(7) Uani 1.0 2 d . . .
C13 C 0.5462(4) 0.2922(3) -0.2485(3) 0.0220(8) Uani 1.0 2 d . . .
C14 C 0.6644(4) 0.2637(3) -0.2902(3) 0.0239(8) Uani 1.0 2 d . . .
C15 C 0.7810(4) 0.2424(3) -0.2168(3) 0.0212(7) Uani 1.0 2 d . . .
C16 C 0.7759(4) 0.2489(3) -0.1022(3) 0.0189(7) Uani 1.0 2 d . . .
C21 C 0.4450(3) 0.3266(3) 0.0335(3) 0.0142(6) Uani 0.5000 2 d . . .
C22 C 0.4234(4) 0.3278(3) -0.0803(3) 0.0165(7) Uani 1.0 2 d . . .
C23 C 0.2992(4) 0.3568(3) -0.1350(3) 0.0205(7) Uani 1.0 2 d . . .
C24 C 0.1952(4) 0.3864(3) -0.0749(3) 0.0235(8) Uani 1.0 2 d . . .
C25 C 0.2158(4) 0.3859(3) 0.0400(3) 0.0231(8) Uani 1.0 2 d . . .
C26 C 0.3403(4) 0.3565(3) 0.0931(3) 0.0208(7) Uani 1.0 2 d . . .
C33 C 0.4754(4) 0.2168(3) 0.3600(3) 0.0163(7) Uani 1.0 2 d . . .
C34 C 0.5577(4) 0.3479(3) 0.4446(3) 0.0170(7) Uani 1.0 2 d . . .
C35 C 0.6269(3) 0.3949(3) 0.3775(3) 0.0157(7) Uani 1.0 2 d . . .
C36 C 0.3778(4) 0.1154(3) 0.3780(3) 0.0219(7) Uani 1.0 2 d . . .
C37 C 0.7251(4) 0.5293(3) 0.4166(3) 0.0200(7) Uani 1.0 2 d . . .
C43 C 0.9476(4) 0.0989(3) 0.1576(3) 0.0188(7) Uani 1.0 2 d . . .
C44 C 1.0534(4) 0.2244(3) 0.2327(3) 0.0195(7) Uani 1.0 2 d . . .
C45 C 0.9709(4) 0.3099(3) 0.2279(3) 0.0162(7) Uani 1.0 2 d . . .
C46 C 0.9684(4) -0.0310(3) 0.1289(3) 0.0276(8) Uani 1.0 2 d . . .
C47 C 1.0233(4) 0.4552(3) 0.2895(3) 0.0233(8) Uani 1.0 2 d . . .
H1A H 0.7789 0.2215 0.4476 0.0314 Uiso 1.0 2 calc R . .
H1B H 0.8651 0.1668 0.3494 0.0314 Uiso 1.0 2 calc R . .
H13 H 0.4670 0.3082 -0.2980 0.0264 Uiso 1.0 2 calc R . .
H14 H 0.6658 0.2587 -0.3690 0.0287 Uiso 1.0 2 calc R . .
H15 H 0.8634 0.2235 -0.2442 0.0254 Uiso 1.0 2 calc R . .
H16 H 0.8562 0.2349 -0.0515 0.0226 Uiso 1.0 2 calc R . .
H23 H 0.2856 0.3562 -0.2142 0.0246 Uiso 1.0 2 calc R . .
H24 H 0.1104 0.4068 -0.1119 0.0282 Uiso 1.0 2 calc R . .
H25 H 0.1448 0.4056 0.0822 0.0277 Uiso 1.0 2 calc R . .
H26 H 0.3542 0.3570 0.1724 0.0249 Uiso 1.0 2 calc R . .
H34 H 0.5652 0.3959 0.5308 0.0204 Uiso 1.0 2 calc R . .
H36A H 0.4420 0.0994 0.4417 0.0262 Uiso 1.0 2 calc R . .
H36B H 0.3292 0.0336 0.2968 0.0262 Uiso 1.0 2 calc R . .
H36C H 0.2983 0.1470 0.4074 0.0262 Uiso 1.0 2 calc R . .
H37A H 0.7294 0.5356 0.3405 0.0239 Uiso 1.0 2 calc R . .
H37B H 0.8289 0.5463 0.4713 0.0239 Uiso 1.0 2 calc R . .
H37C H 0.6815 0.5942 0.4638 0.0239 Uiso 1.0 2 calc R . .
H44 H 1.1596 0.2474 0.2779 0.0234 Uiso 1.0 2 calc R . .
H46A H 1.0677 -0.0301 0.1181 0.0332 Uiso 1.0 2 calc R . .
H46B H 0.8859 -0.0998 0.0501 0.0332 Uiso 1.0 2 calc R . .
H46C H 0.9653 -0.0486 0.1995 0.0332 Uiso 1.0 2 calc R . .
H47A H 0.9611 0.4830 0.2358 0.0279 Uiso 1.0 2 calc R . .
H47B H 1.1313 0.4873 0.3001 0.0279 Uiso 1.0 2 calc R . .
H47C H 1.0119 0.4913 0.3732 0.0279 Uiso 1.0 2 calc R . .



#==============================================================================
_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
_computing_cell_refinement       CrystalClear
_computing_data_reduction        CrystalClear
_computing_structure_solution    'SIR92 (Altomare, et al., 1994)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_publication_material  'CrystalStructure 4.0 (Rigaku, 2010)'
_computing_molecular_graphics    'CrystalStructure 4.0'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Pt1 N11 1.998(4) yes . .
Pt1 N21 2.003(3) yes . .
Pt1 N31 2.053(3) yes . .
Pt1 N41 2.043(3) yes . .
Pt1 C11 1.998(4) yes . .
Pt1 C21 2.003(3) yes . .
Ag1 N32 2.0926(19) yes . .
Ag1 N42 2.0971(18) yes . 2_655
Cl1 C1 1.748(4) yes . .
Cl2 C1 1.762(4) yes . .
N11 C12 1.388(5) yes . .
N11 C16 1.373(5) yes . .
N21 C22 1.373(5) yes . .
N21 C26 1.383(5) yes . .
N31 N32 1.379(4) yes . .
N31 C35 1.348(4) yes . .
N32 C33 1.353(5) yes . .
N41 N42 1.371(4) yes . .
N41 C45 1.343(4) yes . .
N42 C43 1.354(5) yes . .
C11 C12 1.388(5) yes . .
C11 C16 1.373(5) yes . .
C12 C13 1.385(5) yes . .
C12 C22 1.470(5) yes . .
C13 C14 1.380(6) yes . .
C14 C15 1.386(5) yes . .
C15 C16 1.393(6) yes . .
C21 C22 1.373(5) yes . .
C21 C26 1.383(5) yes . .
C22 C23 1.387(5) yes . .
C23 C24 1.380(5) yes . .
C24 C25 1.383(6) yes . .
C25 C26 1.384(5) yes . .
C33 C34 1.386(4) yes . .
C33 C36 1.500(5) yes . .
C34 C35 1.387(6) yes . .
C35 C37 1.492(5) yes . .
C43 C44 1.388(4) yes . .
C43 C46 1.491(6) yes . .
C44 C45 1.400(6) yes . .
C45 C47 1.482(5) yes . .
C1 H1A 0.990 no . .
C1 H1B 0.990 no . .
C13 H13 0.950 no . .
C14 H14 0.950 no . .
C15 H15 0.950 no . .
C16 H16 0.950 no . .
C23 H23 0.950 no . .
C24 H24 0.950 no . .
C25 H25 0.950 no . .
C26 H26 0.950 no . .
C34 H34 0.950 no . .
C36 H36A 0.980 no . .
C36 H36B 0.980 no . .
C36 H36C 0.980 no . .
C37 H37A 0.980 no . .
C37 H37B 0.980 no . .
C37 H37C 0.980 no . .
C44 H44 0.950 no . .
C46 H46A 0.980 no . .
C46 H46B 0.980 no . .
C46 H46C 0.980 no . .
C47 H47A 0.980 no . .
C47 H47B 0.980 no . .
C47 H47C 0.980 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
N11 Pt1 N31 175.62(11) yes . . .
N11 Pt1 N41 94.84(12) yes . . .
N11 Pt1 C21 81.05(13) yes . . .
N21 Pt1 N31 94.70(12) yes . . .
N21 Pt1 N41 175.69(11) yes . . .
N21 Pt1 C11 81.05(13) yes . . .
N31 Pt1 N41 89.38(11) yes . . .
N31 Pt1 C11 175.62(11) yes . . .
N31 Pt1 C21 94.70(12) yes . . .
N41 Pt1 C11 94.84(12) yes . . .
N41 Pt1 C21 175.69(11) yes . . .
N32 Ag1 N42 161.89(11) yes . . 2_655
Pt1 N11 C12 115.1(3) yes . . .
Pt1 N11 C16 126.4(3) yes . . .
C12 N11 C16 118.5(3) yes . . .
Pt1 N21 C22 115.6(3) yes . . .
Pt1 N21 C26 126.2(3) yes . . .
C22 N21 C26 118.2(3) yes . . .
Pt1 N31 N32 117.91(15) yes . . .
Pt1 N31 C35 133.3(3) yes . . .
N32 N31 C35 108.6(3) yes . . .
Ag1 N32 N31 116.00(19) yes . . .
Ag1 N32 C33 133.87(19) yes . . .
N31 N32 C33 107.4(2) yes . . .
Pt1 N41 N42 117.63(15) yes . . .
Pt1 N41 C45 133.3(3) yes . . .
N42 N41 C45 109.0(3) yes . . .
Ag1 N42 N41 119.18(19) yes 2_655 . .
Ag1 N42 C43 127.93(19) yes 2_655 . .
N41 N42 C43 107.7(2) yes . . .
Cl1 C1 Cl2 111.2(3) yes . . .
Pt1 C11 C12 115.1(3) yes . . .
Pt1 C11 C16 126.4(3) yes . . .
C12 C11 C16 118.5(3) yes . . .
N11 C12 C13 120.6(3) yes . . .
N11 C12 C22 114.2(3) yes . . .
C11 C12 C13 120.6(3) yes . . .
C11 C12 C22 114.2(3) yes . . .
C13 C12 C22 125.2(3) yes . . .
C12 C13 C14 120.4(4) yes . . .
C13 C14 C15 119.7(4) yes . . .
C14 C15 C16 119.2(4) yes . . .
N11 C16 C15 121.6(3) yes . . .
C11 C16 C15 121.6(3) yes . . .
Pt1 C21 C22 115.6(3) yes . . .
Pt1 C21 C26 126.2(3) yes . . .
C22 C21 C26 118.2(3) yes . . .
N21 C22 C12 114.1(3) yes . . .
N21 C22 C23 121.1(4) yes . . .
C12 C22 C21 114.1(3) yes . . .
C12 C22 C23 124.8(4) yes . . .
C21 C22 C23 121.1(4) yes . . .
C22 C23 C24 120.3(4) yes . . .
C23 C24 C25 119.2(4) yes . . .
C24 C25 C26 119.7(4) yes . . .
N21 C26 C25 121.4(4) yes . . .
C21 C26 C25 121.4(4) yes . . .
N32 C33 C34 109.3(3) yes . . .
N32 C33 C36 120.3(3) yes . . .
C34 C33 C36 130.4(3) yes . . .
C33 C34 C35 105.9(3) yes . . .
N31 C35 C34 108.8(3) yes . . .
N31 C35 C37 120.6(4) yes . . .
C34 C35 C37 130.6(3) yes . . .
N42 C43 C44 109.1(3) yes . . .
N42 C43 C46 120.9(3) yes . . .
C44 C43 C46 130.0(3) yes . . .
C43 C44 C45 105.6(3) yes . . .
N41 C45 C44 108.5(3) yes . . .
N41 C45 C47 121.5(3) yes . . .
C44 C45 C47 130.0(3) yes . . .
Cl1 C1 H1A 109.387 no . . .
Cl1 C1 H1B 109.390 no . . .
Cl2 C1 H1A 109.389 no . . .
Cl2 C1 H1B 109.391 no . . .
H1A C1 H1B 108.013 no . . .
C12 C13 H13 119.820 no . . .
C14 C13 H13 119.829 no . . .
C13 C14 H14 120.153 no . . .
C15 C14 H14 120.151 no . . .
C14 C15 H15 120.392 no . . .
C16 C15 H15 120.388 no . . .
N11 C16 H16 119.225 no . . .
C11 C16 H16 119.225 no . . .
C15 C16 H16 119.214 no . . .
C22 C23 H23 119.865 no . . .
C24 C23 H23 119.874 no . . .
C23 C24 H24 120.397 no . . .
C25 C24 H24 120.383 no . . .
C24 C25 H25 120.128 no . . .
C26 C25 H25 120.127 no . . .
N21 C26 H26 119.280 no . . .
C21 C26 H26 119.280 no . . .
C25 C26 H26 119.280 no . . .
C33 C34 H34 127.035 no . . .
C35 C34 H34 127.042 no . . .
C33 C36 H36A 109.476 no . . .
C33 C36 H36B 109.476 no . . .
C33 C36 H36C 109.467 no . . .
H36A C36 H36B 109.471 no . . .
H36A C36 H36C 109.469 no . . .
H36B C36 H36C 109.469 no . . .
C35 C37 H37A 109.470 no . . .
C35 C37 H37B 109.470 no . . .
C35 C37 H37C 109.473 no . . .
H37A C37 H37B 109.472 no . . .
H37A C37 H37C 109.467 no . . .
H37B C37 H37C 109.476 no . . .
C43 C44 H44 127.186 no . . .
C45 C44 H44 127.184 no . . .
C43 C46 H46A 109.474 no . . .
C43 C46 H46B 109.472 no . . .
C43 C46 H46C 109.475 no . . .
H46A C46 H46B 109.471 no . . .
H46A C46 H46C 109.468 no . . .
H46B C46 H46C 109.467 no . . .
C45 C47 H47A 109.475 no . . .
C45 C47 H47B 109.475 no . . .
C45 C47 H47C 109.469 no . . .
H47A C47 H47B 109.475 no . . .
H47A C47 H47C 109.466 no . . .
H47B C47 H47C 109.467 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
N11 Pt1 N21 C22 0.14(15) no . . . .
N11 Pt1 N21 C26 -178.0(2) no . . . .
N21 Pt1 N11 C12 -0.70(15) no . . . .
N21 Pt1 N11 C16 178.9(2) no . . . .
N11 Pt1 N41 N42 -88.26(19) no . . . .
N11 Pt1 N41 C45 92.8(3) no . . . .
N41 Pt1 N11 C12 177.97(15) no . . . .
N41 Pt1 N11 C16 -2.38(19) no . . . .
N11 Pt1 C21 C22 0.14(15) no . . . .
N11 Pt1 C21 C26 -178.0(2) no . . . .
C21 Pt1 N11 C12 -0.70(15) no . . . .
C21 Pt1 N11 C16 178.9(2) no . . . .
N21 Pt1 N31 N32 85.85(18) no . . . .
N21 Pt1 N31 C35 -88.6(3) no . . . .
N31 Pt1 N21 C22 -178.76(15) no . . . .
N31 Pt1 N21 C26 3.10(19) no . . . .
N21 Pt1 C11 C12 -0.70(15) no . . . .
N21 Pt1 C11 C16 178.9(2) no . . . .
C11 Pt1 N21 C22 0.14(15) no . . . .
C11 Pt1 N21 C26 -178.0(2) no . . . .
N31 Pt1 N41 N42 90.54(18) no . . . .
N31 Pt1 N41 C45 -88.4(3) no . . . .
N41 Pt1 N31 N32 -92.74(18) no . . . .
N41 Pt1 N31 C35 92.8(3) no . . . .
N31 Pt1 C21 C22 -178.76(15) no . . . .
N31 Pt1 C21 C26 3.10(19) no . . . .
C21 Pt1 N31 N32 85.85(18) no . . . .
C21 Pt1 N31 C35 -88.6(3) no . . . .
N41 Pt1 C11 C12 177.97(15) no . . . .
N41 Pt1 C11 C16 -2.38(19) no . . . .
C11 Pt1 N41 N42 -88.26(19) no . . . .
C11 Pt1 N41 C45 92.8(3) no . . . .
C11 Pt1 C21 C22 0.14(15) no . . . .
C11 Pt1 C21 C26 -178.0(2) no . . . .
C21 Pt1 C11 C12 -0.70(15) no . . . .
C21 Pt1 C11 C16 178.9(2) no . . . .
Pt1 N11 C12 C13 -179.59(16) no . . . .
Pt1 N11 C12 C22 1.1(3) no . . . .
Pt1 N11 C16 C15 179.25(15) no . . . .
C12 N11 C16 C15 -1.1(4) no . . . .
C16 N11 C12 C13 0.7(4) no . . . .
C16 N11 C12 C22 -178.6(2) no . . . .
Pt1 N21 C22 C12 0.4(3) no . . . .
Pt1 N21 C22 C23 -179.03(16) no . . . .
Pt1 N21 C26 C25 178.74(16) no . . . .
C22 N21 C26 C25 0.7(4) no . . . .
C26 N21 C22 C12 178.7(2) no . . . .
C26 N21 C22 C23 -0.7(4) no . . . .
Pt1 N31 N32 Ag1 -12.1(3) no . . . .
Pt1 N31 N32 C33 -175.97(15) no . . . .
Pt1 N31 C35 C34 175.54(18) no . . . .
Pt1 N31 C35 C37 -3.3(5) no . . . .
N32 N31 C35 C34 0.7(4) no . . . .
N32 N31 C35 C37 -178.1(3) no . . . .
C35 N31 N32 Ag1 163.6(2) no . . . .
C35 N31 N32 C33 -0.2(3) no . . . .
Ag1 N32 C33 C34 -160.1(2) no . . . .
Ag1 N32 C33 C36 20.6(5) no . . . .
N31 N32 C33 C34 -0.3(4) no . . . .
N31 N32 C33 C36 -179.7(3) no . . . .
Pt1 N41 N42 Ag1 24.6(3) no . . . 2_655
Pt1 N41 N42 C43 -178.90(15) no . . . .
Pt1 N41 C45 C44 179.00(19) no . . . .
Pt1 N41 C45 C47 -1.3(5) no . . . .
N42 N41 C45 C44 -0.0(4) no . . . .
N42 N41 C45 C47 179.7(3) no . . . .
C45 N41 N42 Ag1 -156.2(3) no . . . 2_655
C45 N41 N42 C43 0.3(4) no . . . .
Ag1 N42 C43 C44 153.4(2) no 2_655 . . .
Ag1 N42 C43 C46 -27.3(5) no 2_655 . . .
N41 N42 C43 C44 -0.5(4) no . . . .
N41 N42 C43 C46 178.9(3) no . . . .
Pt1 C11 C12 C13 -179.59(16) no . . . .
Pt1 C11 C12 C22 1.1(3) no . . . .
Pt1 C11 C16 C15 179.25(15) no . . . .
C12 C11 C16 C15 -1.1(4) no . . . .
C16 C11 C12 C13 0.7(4) no . . . .
C16 C11 C12 C22 -178.6(2) no . . . .
N11 C12 C13 C14 0.3(4) no . . . .
N11 C12 C22 N21 -1.0(4) no . . . .
N11 C12 C22 C21 -1.0(4) no . . . .
N11 C12 C22 C23 178.4(2) no . . . .
C11 C12 C13 C14 0.3(4) no . . . .
C11 C12 C22 N21 -1.0(4) no . . . .
C11 C12 C22 C21 -1.0(4) no . . . .
C11 C12 C22 C23 178.4(2) no . . . .
C13 C12 C22 N21 179.7(3) no . . . .
C13 C12 C22 C21 179.7(3) no . . . .
C13 C12 C22 C23 -0.8(4) no . . . .
C22 C12 C13 C14 179.5(3) no . . . .
C12 C13 C14 C15 -1.0(4) no . . . .
C13 C14 C15 C16 0.6(4) no . . . .
C14 C15 C16 N11 0.4(4) no . . . .
C14 C15 C16 C11 0.4(4) no . . . .
Pt1 C21 C22 C12 0.4(3) no . . . .
Pt1 C21 C22 C23 -179.03(16) no . . . .
Pt1 C21 C26 C25 178.74(16) no . . . .
C22 C21 C26 C25 0.7(4) no . . . .
C26 C21 C22 C12 178.7(2) no . . . .
C26 C21 C22 C23 -0.7(4) no . . . .
N21 C22 C23 C24 0.6(4) no . . . .
C12 C22 C23 C24 -178.7(3) no . . . .
C21 C22 C23 C24 0.6(4) no . . . .
C22 C23 C24 C25 -0.4(4) no . . . .
C23 C24 C25 C26 0.4(4) no . . . .
C24 C25 C26 N21 -0.5(4) no . . . .
C24 C25 C26 C21 -0.5(4) no . . . .
N32 C33 C34 C35 0.8(4) no . . . .
C36 C33 C34 C35 -180.0(3) no . . . .
C33 C34 C35 N31 -0.9(4) no . . . .
C33 C34 C35 C37 177.8(3) no . . . .
N42 C43 C44 C45 0.4(4) no . . . .
C46 C43 C44 C45 -178.8(4) no . . . .
C43 C44 C45 N41 -0.3(4) no . . . .
C43 C44 C45 C47 -180.0(4) no . . . .

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
Pt1 Ag1 3.2815(7) no . .
Pt1 Ag1 3.4301(8) no . 2_655
Pt1 C37 3.522(3) no . .
Pt1 C47 3.526(3) no . .
Ag1 Ag1 3.1772(7) no . 2_655
Ag1 N11 3.598(4) no . 2_655
Ag1 N21 3.587(4) no . .
Ag1 C11 3.598(4) no . 2_655
Ag1 C21 3.587(4) no . .
Ag1 C46 3.498(4) no . 2_655
N11 C14 2.789(5) no . .
N21 C24 2.792(5) no . .
N31 N42 3.577(4) no . .
N31 C26 3.131(5) no . .
N32 C26 3.585(5) no . .
N41 C16 3.127(5) no . .
C11 C14 2.789(5) no . .
C12 C15 2.766(5) no . .
C13 C16 2.750(5) no . .
C13 C23 3.060(5) no . .
C21 C24 2.792(5) no . .
C22 C25 2.754(5) no . .
C23 C26 2.744(6) no . .
Cl1 C12 3.339(3) no . 2_655
Cl1 C13 3.323(4) no . 2_655
N11 C24 3.469(4) no . 2_665
N21 C23 3.573(4) no . 2_665
N32 C1 3.535(5) no . .
N42 C1 3.528(5) no . .
C1 N32 3.535(5) no . .
C1 N42 3.528(5) no . .
C1 C33 3.555(5) no . .
C1 C43 3.456(6) no . .
C11 C24 3.469(4) no . 2_665
C12 Cl1 3.339(3) no . 2_655
C12 C24 3.507(4) no . 2_665
C12 C25 3.542(5) no . 2_665
C13 Cl1 3.323(4) no . 2_655
C13 C25 3.480(4) no . 2_665
C13 C26 3.583(5) no . 2_665
C21 C23 3.573(4) no . 2_665
C22 C22 3.516(4) no . 2_665
C22 C23 3.561(4) no . 2_665
C23 N21 3.573(4) no . 2_665
C23 C21 3.573(4) no . 2_665
C23 C22 3.561(4) no . 2_665
C24 N11 3.469(4) no . 2_665
C24 C11 3.469(4) no . 2_665
C24 C12 3.507(4) no . 2_665
C25 C12 3.542(5) no . 2_665
C25 C13 3.480(4) no . 2_665
C26 C13 3.583(5) no . 2_665
C33 C1 3.555(5) no . .
C43 C1 3.456(6) no . .
C43 C46 3.596(6) no . 2_755
C46 C43 3.596(6) no . 2_755
Pt1 H16 3.1208 no . .
Pt1 H26 3.1316 no . .
Pt1 H37A 2.9663 no . .
Pt1 H47A 3.0869 no . .
Ag1 H16 3.4297 no . 2_655
Ag1 H26 3.5560 no . .
Ag1 H36B 3.0297 no . .
Ag1 H46B 2.9202 no . 2_655
N11 H13 3.2638 no . .
N11 H15 3.2681 no . .
N11 H47A 3.5445 no . .
N21 H23 3.2556 no . .
N21 H25 3.2673 no . .
N21 H37A 3.5455 no . .
N21 H46B 3.3372 no . 2_655
N31 H26 2.5967 no . .
N31 H34 3.1406 no . .
N31 H37A 2.5307 no . .
N31 H37B 3.0004 no . .
N31 H37C 3.1624 no . .
N32 H26 2.9613 no . .
N32 H34 3.1507 no . .
N32 H36A 3.0693 no . .
N32 H36B 2.5228 no . .
N32 H36C 3.1236 no . .
N41 H16 2.5948 no . .
N41 H44 3.1437 no . .
N41 H47A 2.5768 no . .
N41 H47B 3.2102 no . .
N41 H47C 2.9078 no . .
N42 H16 3.0021 no . .
N42 H44 3.1522 no . .
N42 H46A 3.1964 no . .
N42 H46B 2.5558 no . .
N42 H46C 2.9687 no . .
C11 H13 3.2638 no . .
C11 H15 3.2681 no . .
C11 H47A 3.5445 no . .
C12 H14 3.2563 no . .
C12 H16 3.2325 no . .
C12 H23 2.7255 no . .
C13 H15 3.2521 no . .
C13 H23 2.7904 no . .
C14 H16 3.2521 no . .
C14 H36B 3.4965 no . 2_655
C15 H13 3.2496 no . .
C15 H36B 2.8791 no . 2_655
C16 H14 3.2589 no . .
C16 H36B 2.9784 no . 2_655
C21 H23 3.2556 no . .
C21 H25 3.2673 no . .
C21 H37A 3.5455 no . .
C21 H46B 3.3372 no . 2_655
C22 H13 2.7312 no . .
C22 H24 3.2588 no . .
C22 H26 3.2229 no . .
C23 H13 2.7922 no . .
C23 H25 3.2439 no . .
C24 H26 3.2475 no . .
C24 H46B 3.4895 no . 2_655
C24 H46C 3.4884 no . 2_655
C25 H23 3.2429 no . .
C25 H46B 2.9614 no . 2_655
C25 H46C 3.5815 no . 2_655
C26 H24 3.2544 no . .
C26 H46B 2.8740 no . 2_655
C33 H26 3.4695 no . .
C34 H26 3.5012 no . .
C34 H36A 2.9239 no . .
C34 H36B 3.3672 no . .
C34 H36C 2.8797 no . .
C34 H37A 3.3510 no . .
C34 H37B 2.9890 no . .
C34 H37C 2.8188 no . .
C35 H26 2.9629 no . .
C36 H34 2.9553 no . .
C37 H26 3.5726 no . .
C37 H34 2.9548 no . .
C37 H47A 3.4760 no . .
C37 H47C 2.9720 no . .
C43 H16 3.5860 no . .
C44 H46A 2.7910 no . .
C44 H46B 3.3401 no . .
C44 H46C 3.0053 no . .
C44 H47A 3.3239 no . .
C44 H47B 2.7599 no . .
C44 H47C 3.0604 no . .
C45 H16 3.0213 no . .
C46 H44 2.9454 no . .
C47 H37A 3.2232 no . .
C47 H37B 3.2041 no . .
C47 H44 2.9518 no . .
H13 H14 2.3298 no . .
H13 H23 2.2515 no . .
H14 H15 2.3437 no . .
H15 H16 2.3377 no . .
H15 H36B 2.9568 no . 2_655
H16 H36B 3.1176 no . 2_655
H16 H47A 3.2757 no . .
H23 H24 2.3337 no . .
H24 H25 2.3406 no . .
H25 H26 2.3257 no . .
H25 H46B 3.2107 no . 2_655
H26 H37A 3.3855 no . .
H26 H46B 3.0778 no . 2_655
H34 H36A 3.0887 no . .
H34 H36C 3.0099 no . .
H34 H37B 3.2018 no . .
H34 H37C 2.9124 no . .
H37A H47A 2.8409 no . .
H37A H47C 2.7927 no . .
H37B H47A 3.2887 no . .
H37B H47C 2.3788 no . .
H44 H46A 2.8571 no . .
H44 H46C 3.2454 no . .
H44 H47B 2.8061 no . .
H44 H47C 3.3368 no . .
Ag1 H46A 3.1664 no . 1_455
Cl1 H13 3.4004 no . 2_655
Cl1 H36A 3.2119 no . .
Cl1 H46C 3.4145 no . .
Cl2 H15 3.0724 no . 1_556
Cl2 H23 3.0802 no . 1_656
Cl2 H37A 3.2450 no . 2_766
Cl2 H37B 3.3395 no . 2_766
Cl2 H47A 3.5471 no . 2_766
Cl2 H47C 3.4814 no . 2_766
N11 H24 3.4013 no . 2_665
N21 H23 3.5139 no . 2_665
N31 H1A 3.1161 no . .
N31 H1B 3.4517 no . .
N32 H1A 3.0075 no . .
N32 H1B 3.5127 no . .
N32 H44 3.4691 no . 1_455
N41 H1B 2.8397 no . .
N42 H1B 2.6317 no . .
N42 H46A 3.1401 no . 2_755
C1 H14 3.3122 no . 1_556
C1 H46C 3.4623 no . .
C11 H24 3.4013 no . 2_665
C13 H25 3.5671 no . 2_665
C13 H34 3.4412 no . 1_554
C13 H36A 3.2956 no . 1_554
C14 H1A 3.5180 no . 1_554
C14 H25 3.4608 no . 2_665
C14 H34 3.2569 no . 1_554
C14 H36A 2.9907 no . 1_554
C14 H47B 3.2766 no . 2_765
C15 H24 2.9895 no . 1_655
C15 H46A 3.5890 no . 2_755
C16 H24 3.4243 no . 1_655
C16 H24 3.5768 no . 2_665
C16 H25 3.3365 no . 1_655
C16 H46A 3.1749 no . 2_755
C21 H23 3.5139 no . 2_665
C23 H37A 3.2515 no . 2_665
C24 H15 3.0389 no . 1_455
C24 H16 3.5140 no . 1_455
C24 H47A 3.2410 no . 2_665
C25 H16 3.2121 no . 1_455
C25 H47B 3.2753 no . 1_455
C26 H13 3.4970 no . 2_665
C33 H1A 2.8033 no . .
C33 H14 3.1717 no . 1_556
C33 H37C 3.2653 no . 2_666
C33 H44 3.0636 no . 1_455
C34 H1A 2.7954 no . .
C34 H14 2.9548 no . 1_556
C34 H34 3.3700 no . 2_666
C34 H37C 2.8356 no . 2_666
C34 H44 3.5336 no . 1_455
C34 H47B 3.2754 no . 2_766
C35 H1A 3.0018 no . .
C35 H34 3.3251 no . 2_666
C35 H47B 3.5819 no . 2_766
C35 H47C 3.5783 no . 2_766
C36 H1A 3.5430 no . .
C36 H13 3.4550 no . 1_556
C36 H14 3.1419 no . 1_556
C36 H37C 3.4043 no . 2_666
C36 H44 3.1343 no . 1_455
C36 H46A 3.3021 no . 1_455
C37 H13 3.3934 no . 2_665
C37 H23 3.2844 no . 2_665
C37 H34 3.1717 no . 2_666
C37 H44 3.3209 no . 2_766
C37 H47B 3.5292 no . 2_766
C37 H47C 3.2629 no . 2_766
C43 H1B 2.5242 no . .
C43 H46A 3.1031 no . 2_755
C43 H46B 3.3112 no . 2_755
C44 H1B 2.7010 no . .
C44 H25 3.4860 no . 1_655
C44 H26 3.3856 no . 1_655
C44 H36C 3.3015 no . 1_655
C44 H37B 3.2573 no . 2_766
C44 H37C 3.4266 no . 2_766
C44 H46B 3.4106 no . 2_755
C45 H1B 2.8798 no . .
C45 H25 3.1013 no . 1_655
C45 H37B 3.2291 no . 2_766
C46 H1B 3.2631 no . .
C46 H15 3.5643 no . 2_755
C46 H16 3.1348 no . 2_755
C46 H36B 3.3025 no . 1_655
C46 H36C 3.5237 no . 1_655
C46 H46A 3.3634 no . 2_755
C46 H46B 3.5563 no . 2_755
C47 H1A 3.5748 no . 2_766
C47 H24 3.3858 no . 2_665
C47 H25 2.9309 no . 1_655
C47 H37B 2.9538 no . 2_766
H1A N31 3.1161 no . .
H1A N32 3.0075 no . .
H1A C14 3.5180 no . 1_556
H1A C33 2.8033 no . .
H1A C34 2.7954 no . .
H1A C35 3.0018 no . .
H1A C36 3.5430 no . .
H1A C47 3.5748 no . 2_766
H1A H14 2.6353 no . 1_556
H1A H34 3.1933 no . .
H1A H36A 3.2225 no . .
H1A H47B 3.3165 no . 2_766
H1A H47C 3.0864 no . 2_766
H1B N31 3.4517 no . .
H1B N32 3.5127 no . .
H1B N41 2.8397 no . .
H1B N42 2.6317 no . .
H1B C43 2.5242 no . .
H1B C44 2.7010 no . .
H1B C45 2.8798 no . .
H1B C46 3.2631 no . .
H1B H37B 3.4460 no . 2_766
H1B H44 3.2177 no . .
H1B H46C 2.9374 no . .
H13 Cl1 3.4004 no . 2_655
H13 C26 3.4970 no . 2_665
H13 C36 3.4550 no . 1_554
H13 C37 3.3934 no . 2_665
H13 H26 3.4806 no . 2_665
H13 H34 2.9621 no . 1_554
H13 H36A 3.0438 no . 1_554
H13 H36C 3.1148 no . 1_554
H13 H37A 2.9624 no . 2_665
H13 H37C 2.9448 no . 2_665
H14 C1 3.3122 no . 1_554
H14 C33 3.1717 no . 1_554
H14 C34 2.9548 no . 1_554
H14 C36 3.1419 no . 1_554
H14 H1A 2.6353 no . 1_554
H14 H34 2.5971 no . 1_554
H14 H36A 2.4483 no . 1_554
H14 H36C 3.4875 no . 1_554
H14 H47B 2.8993 no . 2_765
H15 Cl2 3.0724 no . 1_554
H15 C24 3.0389 no . 1_655
H15 C46 3.5643 no . 2_755
H15 H24 2.4895 no . 1_655
H15 H46A 3.3308 no . 2_755
H15 H46C 2.9994 no . 2_755
H15 H47A 3.5070 no . 2_765
H16 C24 3.5140 no . 1_655
H16 C25 3.2121 no . 1_655
H16 C46 3.1348 no . 2_755
H16 H24 3.2841 no . 1_655
H16 H25 2.7041 no . 1_655
H16 H46A 2.5184 no . 2_755
H16 H46B 3.1604 no . 2_755
H16 H46C 3.2502 no . 2_755
H23 Cl2 3.0802 no . 1_454
H23 N21 3.5139 no . 2_665
H23 C21 3.5139 no . 2_665
H23 C37 3.2844 no . 2_665
H23 H37A 2.3852 no . 2_665
H23 H37C 3.4296 no . 2_665
H23 H47A 3.3073 no . 2_665
H24 N11 3.4013 no . 2_665
H24 C11 3.4013 no . 2_665
H24 C15 2.9895 no . 1_455
H24 C16 3.4243 no . 1_455
H24 C16 3.5768 no . 2_665
H24 C47 3.3858 no . 2_665
H24 H15 2.4895 no . 1_455
H24 H16 3.2841 no . 1_455
H24 H25 3.5578 no . 2_565
H24 H47A 2.4432 no . 2_665
H25 C13 3.5671 no . 2_665
H25 C14 3.4608 no . 2_665
H25 C16 3.3365 no . 1_455
H25 C44 3.4860 no . 1_455
H25 C45 3.1013 no . 1_455
H25 C47 2.9309 no . 1_455
H25 H16 2.7041 no . 1_455
H25 H24 3.5578 no . 2_565
H25 H47A 2.8580 no . 1_455
H25 H47B 2.4908 no . 1_455
H26 C44 3.3856 no . 1_455
H26 H13 3.4806 no . 2_665
H26 H34 3.3834 no . 2_666
H26 H44 2.9034 no . 1_455
H26 H47B 3.1777 no . 1_455
H34 C13 3.4412 no . 1_556
H34 C14 3.2569 no . 1_556
H34 C34 3.3700 no . 2_666
H34 C35 3.3251 no . 2_666
H34 C37 3.1717 no . 2_666
H34 H1A 3.1933 no . .
H34 H13 2.9621 no . 1_556
H34 H14 2.5971 no . 1_556
H34 H26 3.3834 no . 2_666
H34 H34 3.2274 no . 2_666
H34 H37A 3.5852 no . 2_666
H34 H37C 2.3791 no . 2_666
H34 H47B 2.7925 no . 2_766
H36A Cl1 3.2119 no . .
H36A C13 3.2956 no . 1_556
H36A C14 2.9907 no . 1_556
H36A H1A 3.2225 no . .
H36A H13 3.0438 no . 1_556
H36A H14 2.4483 no . 1_556
H36A H36A 3.4374 no . 2_656
H36B C46 3.3025 no . 1_455
H36B H44 3.2963 no . 1_455
H36B H46A 2.6236 no . 1_455
H36B H46C 3.1789 no . 1_455
H36C C44 3.3015 no . 1_455
H36C C46 3.5237 no . 1_455
H36C H13 3.1148 no . 1_556
H36C H14 3.4875 no . 1_556
H36C H37C 2.7432 no . 2_666
H36C H44 2.6143 no . 1_455
H36C H46A 3.2000 no . 1_455
H36C H46C 3.2230 no . 1_455
H37A Cl2 3.2450 no . 2_766
H37A C23 3.2515 no . 2_665
H37A H13 2.9624 no . 2_665
H37A H23 2.3852 no . 2_665
H37A H34 3.5852 no . 2_666
H37B Cl2 3.3395 no . 2_766
H37B C44 3.2573 no . 2_766
H37B C45 3.2291 no . 2_766
H37B C47 2.9538 no . 2_766
H37B H1B 3.4460 no . 2_766
H37B H44 2.9970 no . 2_766
H37B H47B 2.9488 no . 2_766
H37B H47C 2.3917 no . 2_766
H37C C33 3.2653 no . 2_666
H37C C34 2.8356 no . 2_666
H37C C36 3.4043 no . 2_666
H37C C44 3.4266 no . 2_766
H37C H13 2.9448 no . 2_665
H37C H23 3.4296 no . 2_665
H37C H34 2.3791 no . 2_666
H37C H36C 2.7432 no . 2_666
H37C H44 2.7585 no . 2_766
H44 N32 3.4691 no . 1_655
H44 C33 3.0636 no . 1_655
H44 C34 3.5336 no . 1_655
H44 C36 3.1343 no . 1_655
H44 C37 3.3209 no . 2_766
H44 H1B 3.2177 no . .
H44 H26 2.9034 no . 1_655
H44 H36B 3.2963 no . 1_655
H44 H36C 2.6143 no . 1_655
H44 H37B 2.9970 no . 2_766
H44 H37C 2.7585 no . 2_766
H44 H46B 3.5462 no . 2_755
H46A Ag1 3.1664 no . 1_655
H46A N42 3.1401 no . 2_755
H46A C15 3.5890 no . 2_755
H46A C16 3.1749 no . 2_755
H46A C36 3.3021 no . 1_655
H46A C43 3.1031 no . 2_755
H46A C46 3.3634 no . 2_755
H46A H15 3.3308 no . 2_755
H46A H16 2.5184 no . 2_755
H46A H36B 2.6236 no . 1_655
H46A H36C 3.2000 no . 1_655
H46A H46A 3.3018 no . 2_755
H46A H46B 3.1106 no . 2_755
H46B C43 3.3112 no . 2_755
H46B C44 3.4106 no . 2_755
H46B C46 3.5563 no . 2_755
H46B H16 3.1604 no . 2_755
H46B H44 3.5462 no . 2_755
H46B H46A 3.1106 no . 2_755
H46C Cl1 3.4145 no . .
H46C C1 3.4623 no . .
H46C H1B 2.9374 no . .
H46C H15 2.9994 no . 2_755
H46C H16 3.2502 no . 2_755
H46C H36B 3.1789 no . 1_655
H46C H36C 3.2230 no . 1_655
H47A Cl2 3.5471 no . 2_766
H47A C24 3.2410 no . 2_665
H47A H15 3.5070 no . 2_765
H47A H23 3.3073 no . 2_665
H47A H24 2.4432 no . 2_665
H47A H25 2.8580 no . 1_655
H47B C14 3.2766 no . 2_765
H47B C25 3.2753 no . 1_655
H47B C34 3.2754 no . 2_766
H47B C35 3.5819 no . 2_766
H47B C37 3.5292 no . 2_766
H47B H1A 3.3165 no . 2_766
H47B H14 2.8993 no . 2_765
H47B H25 2.4908 no . 1_655
H47B H26 3.1777 no . 1_655
H47B H34 2.7925 no . 2_766
H47B H37B 2.9488 no . 2_766
H47C Cl2 3.4814 no . 2_766
H47C C35 3.5783 no . 2_766
H47C C37 3.2629 no . 2_766
H47C H1A 3.0864 no . 2_766
H47C H37B 2.3917 no . 2_766
H47C H47C 3.1080 no . 2_766
_chemical_name_systematic        '[Pt2Ag2(ppy)2(Me2pz)4]'
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: dichloromethane/n-hexane'
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_2b
_database_code_depnum_ccdc_archive 'CCDC 1438722'
_audit_update_record             
;
2015-11-25 deposited with the CCDC.
2016-02-22 downloaded from the CCDC.
;
#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C44 H44 Ag2 Cl4 F4 N10 Pt2'
_chemical_formula_moiety         'C42 H40 Ag2 F4 N10 Pt2, 2(C H2 Cl2)'
_chemical_formula_weight         1536.62
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_Int_Tables_number      2
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +X,+Y,+Z
2 -X,-Y,-Z
#------------------------------------------------------------------------------
_cell_length_a                   9.841(3)
_cell_length_b                   11.774(3)
_cell_length_c                   12.813(2)
_cell_angle_alpha                59.904(15)
_cell_angle_beta                 67.362(19)
_cell_angle_gamma                79.67(3)
_cell_volume                     1185.4(6)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    4163
_cell_measurement_theta_min      3.03
_cell_measurement_theta_max      27.48
_cell_measurement_temperature    93
#------------------------------------------------------------------------------
_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.070
_exptl_crystal_size_min          0.040
_exptl_crystal_density_diffrn    2.152
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             732.00
_exptl_absorpt_coefficient_mu    6.956
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_absorpt_correction_T_min  0.659
_exptl_absorpt_correction_T_max  0.757

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      93
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku Saturn724'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 7.111
_diffrn_reflns_number            9923
_diffrn_reflns_av_R_equivalents  0.0204
_diffrn_reflns_av_sigmaI/netI    0.0378
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_full        27.50
_diffrn_measured_fraction_theta_max 0.986
_diffrn_measured_fraction_theta_full 0.986
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             5363
_reflns_number_gt                4648
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0268
_refine_ls_wR_factor_ref         0.0642
_refine_ls_number_restraints     159
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         5363
_refine_ls_number_parameters     321
_refine_ls_goodness_of_fit_ref   1.073
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0335P)²+0.0000P] 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_diff_density_max         1.510
_refine_diff_density_min         -1.120
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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 for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.4)
;
Ag Ag -0.8971 1.1015
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
F F 0.0171 0.0103
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
N N 0.0061 0.0033
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Pt Pt -1.7033 8.3905
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Cl Cl 0.1484 0.1585
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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 0.361511(19) 0.686071(16) 0.101469(15) 0.01710(6) Uani 1.0 2 d . . .
Ag1 Ag 0.62961(4) 0.47769(3) 0.05392(3) 0.02258(9) Uani 1.0 2 d . . .
Cl1 Cl -0.0055(3) 1.16508(18) 0.5159(2) 0.0817(8) Uani 1.0 2 d . . .
Cl2 Cl 0.2922(2) 1.1361(2) 0.3690(3) 0.0732(6) Uani 1.0 2 d . . .
F13 F 0.5636(6) 1.1262(5) -0.3179(5) 0.0320(14) Uani 0.545(5) 2 d . . .
F15 F 0.1190(6) 0.9776(6) -0.2626(5) 0.0324(14) Uani 0.545(5) 2 d . . .
F23 F 0.6900(7) 1.0913(6) -0.2605(6) 0.0368(18) Uani 0.455(5) 2 d . . .
F25 F 0.8594(7) 0.8325(7) 0.0840(7) 0.0366(18) Uani 0.455(5) 2 d . . .
N21 N 0.5432(5) 0.7923(4) 0.0359(4) 0.0236(10) Uani 0.545(5) 2 d . . .
N11 N 0.3323(5) 0.8345(4) -0.0585(4) 0.0226(10) Uani 0.4553 2 d . . .
N31 N 0.4076(4) 0.5369(4) 0.2584(4) 0.0188(8) Uani 1.0 2 d . . .
N32 N 0.5041(4) 0.4428(4) 0.2413(4) 0.0210(8) Uani 1.0 2 d . . .
N41 N 0.1772(5) 0.5850(4) 0.1555(4) 0.0221(9) Uani 1.0 2 d . . .
N42 N 0.1906(5) 0.4980(4) 0.1115(4) 0.0205(8) Uani 1.0 2 d . . .
C1 C 0.1677(7) 1.2388(6) 0.4179(6) 0.0368(13) Uani 1.0 2 d . . .
C11 C 0.3323(5) 0.8345(4) -0.0585(4) 0.0226(10) Uani 0.545(5) 2 d . . .
C12 C 0.4476(6) 0.9285(5) -0.1354(5) 0.0321(10) Uani 1.0 2 d . . .
C13 C 0.4452(6) 1.0373(5) -0.2512(6) 0.0416(12) Uani 1.0 2 d . . .
C14 C 0.3273(8) 1.0494(6) -0.2906(6) 0.0455(13) Uani 1.0 2 d . . .
C15 C 0.2198(7) 0.9558(6) -0.2114(6) 0.0412(12) Uani 1.0 2 d . . .
C16 C 0.2166(6) 0.8495(5) -0.0969(5) 0.0277(10) Uani 1.0 2 d . . .
C21 C 0.5432(5) 0.7923(4) 0.0359(4) 0.0236(10) Uani 0.4553 2 d . . .
C22 C 0.5645(6) 0.9047(5) -0.0811(5) 0.0310(10) Uani 1.0 2 d . . .
C23 C 0.6869(7) 0.9879(5) -0.1404(5) 0.0421(12) Uani 1.0 2 d . . .
C24 C 0.7853(7) 0.9550(6) -0.0747(6) 0.0467(12) Uani 1.0 2 d . . .
C25 C 0.7576(6) 0.8448(6) 0.0381(6) 0.0417(12) Uani 1.0 2 d . . .
C26 C 0.6415(6) 0.7621(5) 0.0966(5) 0.0284(11) Uani 1.0 2 d . . .
C33 C 0.5240(6) 0.3605(5) 0.3540(5) 0.0223(10) Uani 1.0 2 d . . .
C34 C 0.4406(5) 0.4014(5) 0.4441(5) 0.0228(10) Uani 1.0 2 d . . .
C35 C 0.3688(5) 0.5127(5) 0.3809(4) 0.0203(10) Uani 1.0 2 d . . .
C36 C 0.6249(6) 0.2450(5) 0.3673(5) 0.0289(11) Uani 1.0 2 d . . .
C37 C 0.2679(6) 0.6010(5) 0.4276(5) 0.0255(11) Uani 1.0 2 d . . .
C43 C 0.0567(6) 0.4445(5) 0.1569(5) 0.0240(10) Uani 1.0 2 d . . .
C44 C -0.0445(6) 0.4981(5) 0.2307(5) 0.0280(11) Uani 1.0 2 d . . .
C45 C 0.0353(6) 0.5871(5) 0.2265(4) 0.0226(10) Uani 1.0 2 d . . .
C46 C 0.0365(6) 0.3423(6) 0.1274(6) 0.0357(13) Uani 1.0 2 d . . .
C47 C -0.0154(6) 0.6741(6) 0.2877(5) 0.0344(13) Uani 1.0 2 d . . .
H1A H 0.1592 1.3200 0.3412 0.0441 Uiso 1.0 2 calc R . .
H1B H 0.2051 1.2636 0.4654 0.0441 Uiso 1.0 2 calc R . .
H14 H 0.3225 1.1204 -0.3698 0.0546 Uiso 1.0 2 calc R . .
H16 H 0.1366 0.7883 -0.0460 0.0332 Uiso 1.0 2 calc R . .
H24 H 0.8689 1.0091 -0.1090 0.0561 Uiso 1.0 2 calc R . .
H26 H 0.6290 0.6855 0.1772 0.0341 Uiso 1.0 2 calc R . .
H34 H 0.4341 0.3613 0.5313 0.0273 Uiso 1.0 2 calc R . .
H36A H 0.6879 0.2400 0.4129 0.0347 Uiso 1.0 2 calc R . .
H36B H 0.6865 0.2560 0.2817 0.0347 Uiso 1.0 2 calc R . .
H36C H 0.5659 0.1639 0.4159 0.0347 Uiso 1.0 2 calc R . .
H37A H 0.1722 0.5568 0.4857 0.0306 Uiso 1.0 2 calc R . .
H37B H 0.2551 0.6821 0.3541 0.0306 Uiso 1.0 2 calc R . .
H37C H 0.3103 0.6222 0.4738 0.0306 Uiso 1.0 2 calc R . .
H44 H -0.1468 0.4780 0.2747 0.0336 Uiso 1.0 2 calc R . .
H46A H 0.0324 0.2551 0.2011 0.0428 Uiso 1.0 2 calc R . .
H46B H 0.1193 0.3471 0.0517 0.0428 Uiso 1.0 2 calc R . .
H46C H -0.0556 0.3575 0.1099 0.0428 Uiso 1.0 2 calc R . .
H47A H 0.0434 0.7557 0.2326 0.0413 Uiso 1.0 2 calc R . .
H47B H -0.0032 0.6292 0.3718 0.0413 Uiso 1.0 2 calc R . .
H47C H -0.1194 0.6944 0.2987 0.0413 Uiso 1.0 2 calc R . .



#==============================================================================
_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
_computing_cell_refinement       CrystalClear
_computing_data_reduction        CrystalClear
_computing_structure_solution    'Il Milione (Burla, et al., 2007)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_publication_material  'CrystalStructure 4.0 (Rigaku, 2010)'
_computing_molecular_graphics    'CrystalStructure 4.0'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Pt1 N21 2.015(5) yes . .
Pt1 N11 2.005(4) yes . .
Pt1 N31 2.051(4) yes . .
Pt1 N41 2.041(5) yes . .
Pt1 C11 2.005(4) yes . .
Pt1 C21 2.015(5) yes . .
Ag1 N32 2.090(4) yes . .
Ag1 N42 2.095(4) yes . 2_665
Cl1 C1 1.739(6) yes . .
Cl2 C1 1.731(7) yes . .
F13 C13 1.399(8) yes . .
F15 C15 1.313(10) yes . .
F23 C23 1.397(7) yes . .
F25 C25 1.299(12) yes . .
N21 C22 1.382(6) yes . .
N21 C26 1.358(9) yes . .
N11 C12 1.407(7) yes . .
N11 C16 1.357(9) yes . .
N31 N32 1.373(6) yes . .
N31 C35 1.350(7) yes . .
N32 C33 1.345(7) yes . .
N41 N42 1.364(8) yes . .
N41 C45 1.346(6) yes . .
N42 C43 1.346(7) yes . .
C11 C12 1.407(7) yes . .
C11 C16 1.357(9) yes . .
C12 C13 1.397(7) yes . .
C12 C22 1.480(10) yes . .
C13 C14 1.393(11) yes . .
C14 C15 1.353(9) yes . .
C15 C16 1.363(7) yes . .
C21 C22 1.382(6) yes . .
C21 C26 1.358(9) yes . .
C22 C23 1.400(9) yes . .
C23 C24 1.401(11) yes . .
C24 C25 1.338(7) yes . .
C25 C26 1.350(8) yes . .
C33 C34 1.388(8) yes . .
C33 C36 1.510(7) yes . .
C34 C35 1.384(7) yes . .
C35 C37 1.491(8) yes . .
C43 C44 1.390(8) yes . .
C43 C46 1.494(11) yes . .
C44 C45 1.387(10) yes . .
C45 C47 1.493(10) yes . .
C1 H1A 0.990 no . .
C1 H1B 0.990 no . .
C14 H14 0.950 no . .
C16 H16 0.950 no . .
C24 H24 0.950 no . .
C26 H26 0.950 no . .
C34 H34 0.950 no . .
C36 H36A 0.980 no . .
C36 H36B 0.980 no . .
C36 H36C 0.980 no . .
C37 H37A 0.980 no . .
C37 H37B 0.980 no . .
C37 H37C 0.980 no . .
C44 H44 0.950 no . .
C46 H46A 0.980 no . .
C46 H46B 0.980 no . .
C46 H46C 0.980 no . .
C47 H47A 0.980 no . .
C47 H47B 0.980 no . .
C47 H47C 0.980 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
N21 Pt1 N31 94.12(18) yes . . .
N21 Pt1 N41 176.13(18) yes . . .
N21 Pt1 C11 82.2(2) yes . . .
N11 Pt1 N31 175.81(16) yes . . .
N11 Pt1 N41 94.20(19) yes . . .
N11 Pt1 C21 82.2(2) yes . . .
N31 Pt1 N41 89.45(17) yes . . .
N31 Pt1 C11 175.81(16) yes . . .
N31 Pt1 C21 94.12(18) yes . . .
N41 Pt1 C11 94.20(19) yes . . .
N41 Pt1 C21 176.13(18) yes . . .
N32 Ag1 N42 161.81(19) yes . . 2_665
Pt1 N21 C22 114.7(5) yes . . .
Pt1 N21 C26 125.6(3) yes . . .
C22 N21 C26 119.7(5) yes . . .
Pt1 N11 C12 113.8(4) yes . . .
Pt1 N11 C16 126.5(3) yes . . .
C12 N11 C16 119.7(4) yes . . .
Pt1 N31 N32 118.0(3) yes . . .
Pt1 N31 C35 133.1(4) yes . . .
N32 N31 C35 108.8(4) yes . . .
Ag1 N32 N31 118.6(3) yes . . .
Ag1 N32 C33 131.3(4) yes . . .
N31 N32 C33 107.5(5) yes . . .
Pt1 N41 N42 117.9(3) yes . . .
Pt1 N41 C45 133.2(5) yes . . .
N42 N41 C45 108.8(5) yes . . .
Ag1 N42 N41 117.8(3) yes 2_665 . .
Ag1 N42 C43 129.4(5) yes 2_665 . .
N41 N42 C43 107.9(4) yes . . .
Cl1 C1 Cl2 112.1(4) yes . . .
Pt1 C11 C12 113.8(4) yes . . .
Pt1 C11 C16 126.5(3) yes . . .
C12 C11 C16 119.7(4) yes . . .
N11 C12 C13 121.0(6) yes . . .
N11 C12 C22 114.8(4) yes . . .
C11 C12 C13 121.0(6) yes . . .
C11 C12 C22 114.8(4) yes . . .
C13 C12 C22 124.2(5) yes . . .
F13 C13 C12 116.1(6) yes . . .
F13 C13 C14 125.4(5) yes . . .
C12 C13 C14 118.5(5) yes . . .
C13 C14 C15 117.2(6) yes . . .
F15 C15 C14 110.5(6) yes . . .
F15 C15 C16 123.3(6) yes . . .
C14 C15 C16 126.2(7) yes . . .
N11 C16 C15 117.4(5) yes . . .
C11 C16 C15 117.4(5) yes . . .
Pt1 C21 C22 114.7(5) yes . . .
Pt1 C21 C26 125.6(3) yes . . .
C22 C21 C26 119.7(5) yes . . .
N21 C22 C12 114.4(5) yes . . .
N21 C22 C23 121.5(6) yes . . .
C12 C22 C21 114.4(5) yes . . .
C12 C22 C23 124.0(5) yes . . .
C21 C22 C23 121.5(6) yes . . .
F23 C23 C22 111.7(7) yes . . .
F23 C23 C24 130.9(6) yes . . .
C22 C23 C24 117.4(5) yes . . .
C23 C24 C25 117.7(6) yes . . .
F25 C25 C24 108.3(6) yes . . .
F25 C25 C26 125.5(6) yes . . .
C24 C25 C26 126.1(7) yes . . .
N21 C26 C25 117.5(5) yes . . .
C21 C26 C25 117.5(5) yes . . .
N32 C33 C34 109.4(5) yes . . .
N32 C33 C36 120.6(5) yes . . .
C34 C33 C36 130.0(5) yes . . .
C33 C34 C35 105.9(5) yes . . .
N31 C35 C34 108.4(5) yes . . .
N31 C35 C37 121.4(4) yes . . .
C34 C35 C37 130.2(5) yes . . .
N42 C43 C44 109.0(6) yes . . .
N42 C43 C46 120.6(5) yes . . .
C44 C43 C46 130.4(5) yes . . .
C43 C44 C45 105.6(5) yes . . .
N41 C45 C44 108.6(6) yes . . .
N41 C45 C47 121.8(6) yes . . .
C44 C45 C47 129.6(5) yes . . .
Cl1 C1 H1A 109.187 no . . .
Cl1 C1 H1B 109.194 no . . .
Cl2 C1 H1A 109.189 no . . .
Cl2 C1 H1B 109.190 no . . .
H1A C1 H1B 107.895 no . . .
C13 C14 H14 121.381 no . . .
C15 C14 H14 121.378 no . . .
N11 C16 H16 121.313 no . . .
C11 C16 H16 121.313 no . . .
C15 C16 H16 121.318 no . . .
C23 C24 H24 121.169 no . . .
C25 C24 H24 121.172 no . . .
N21 C26 H26 121.239 no . . .
C21 C26 H26 121.239 no . . .
C25 C26 H26 121.227 no . . .
C33 C34 H34 127.046 no . . .
C35 C34 H34 127.054 no . . .
C33 C36 H36A 109.473 no . . .
C33 C36 H36B 109.467 no . . .
C33 C36 H36C 109.470 no . . .
H36A C36 H36B 109.474 no . . .
H36A C36 H36C 109.474 no . . .
H36B C36 H36C 109.469 no . . .
C35 C37 H37A 109.470 no . . .
C35 C37 H37B 109.468 no . . .
C35 C37 H37C 109.473 no . . .
H37A C37 H37B 109.478 no . . .
H37A C37 H37C 109.468 no . . .
H37B C37 H37C 109.469 no . . .
C43 C44 H44 127.214 no . . .
C45 C44 H44 127.201 no . . .
C43 C46 H46A 109.468 no . . .
C43 C46 H46B 109.472 no . . .
C43 C46 H46C 109.469 no . . .
H46A C46 H46B 109.474 no . . .
H46A C46 H46C 109.476 no . . .
H46B C46 H46C 109.469 no . . .
C45 C47 H47A 109.475 no . . .
C45 C47 H47B 109.465 no . . .
C45 C47 H47C 109.469 no . . .
H47A C47 H47B 109.472 no . . .
H47A C47 H47C 109.476 no . . .
H47B C47 H47C 109.471 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
N21 Pt1 N11 C12 3.1(4) no . . . .
N21 Pt1 N11 C16 -177.7(5) no . . . .
N11 Pt1 N21 C22 -2.6(4) no . . . .
N11 Pt1 N21 C26 177.4(5) no . . . .
N21 Pt1 N31 N32 -82.5(4) no . . . .
N21 Pt1 N31 C35 92.7(4) no . . . .
N31 Pt1 N21 C22 175.4(4) no . . . .
N31 Pt1 N21 C26 -4.6(4) no . . . .
N21 Pt1 C11 C12 3.1(4) no . . . .
N21 Pt1 C11 C16 -177.7(5) no . . . .
C11 Pt1 N21 C22 -2.6(4) no . . . .
C11 Pt1 N21 C26 177.4(5) no . . . .
N11 Pt1 N41 N42 89.2(3) no . . . .
N11 Pt1 N41 C45 -88.6(4) no . . . .
N41 Pt1 N11 C12 -175.5(4) no . . . .
N41 Pt1 N11 C16 3.7(5) no . . . .
N11 Pt1 C21 C22 -2.6(4) no . . . .
N11 Pt1 C21 C26 177.4(5) no . . . .
C21 Pt1 N11 C12 3.1(4) no . . . .
C21 Pt1 N11 C16 -177.7(5) no . . . .
N31 Pt1 N41 N42 -88.7(3) no . . . .
N31 Pt1 N41 C45 93.5(4) no . . . .
N41 Pt1 N31 N32 96.0(4) no . . . .
N41 Pt1 N31 C35 -88.8(4) no . . . .
N31 Pt1 C21 C22 175.4(4) no . . . .
N31 Pt1 C21 C26 -4.6(4) no . . . .
C21 Pt1 N31 N32 -82.5(4) no . . . .
C21 Pt1 N31 C35 92.7(4) no . . . .
N41 Pt1 C11 C12 -175.5(4) no . . . .
N41 Pt1 C11 C16 3.7(5) no . . . .
C11 Pt1 N41 N42 89.2(3) no . . . .
C11 Pt1 N41 C45 -88.6(4) no . . . .
C11 Pt1 C21 C22 -2.6(4) no . . . .
C11 Pt1 C21 C26 177.4(5) no . . . .
C21 Pt1 C11 C12 3.1(4) no . . . .
C21 Pt1 C11 C16 -177.7(5) no . . . .
Pt1 N21 C22 C12 1.6(6) no . . . .
Pt1 N21 C22 C23 -179.0(4) no . . . .
Pt1 N21 C26 C25 179.8(4) no . . . .
C22 N21 C26 C25 -0.2(9) no . . . .
C26 N21 C22 C12 -178.4(5) no . . . .
C26 N21 C22 C23 1.1(9) no . . . .
Pt1 N11 C12 C13 179.1(4) no . . . .
Pt1 N11 C12 C22 -3.2(6) no . . . .
Pt1 N11 C16 C15 -178.0(4) no . . . .
C12 N11 C16 C15 1.2(9) no . . . .
C16 N11 C12 C13 -0.2(9) no . . . .
C16 N11 C12 C22 177.6(5) no . . . .
Pt1 N31 N32 Ag1 12.7(6) no . . . .
Pt1 N31 N32 C33 176.5(3) no . . . .
Pt1 N31 C35 C34 -175.7(3) no . . . .
Pt1 N31 C35 C37 2.6(8) no . . . .
N32 N31 C35 C34 -0.1(6) no . . . .
N32 N31 C35 C37 178.1(4) no . . . .
C35 N31 N32 Ag1 -163.6(4) no . . . .
C35 N31 N32 C33 0.2(6) no . . . .
Ag1 N32 C33 C34 160.8(4) no . . . .
Ag1 N32 C33 C36 -19.1(8) no . . . .
N31 N32 C33 C34 -0.2(6) no . . . .
N31 N32 C33 C36 179.9(4) no . . . .
Pt1 N41 N42 Ag1 -21.5(5) no . . . 2_665
Pt1 N41 N42 C43 -179.1(2) no . . . .
Pt1 N41 C45 C44 179.0(3) no . . . .
Pt1 N41 C45 C47 -1.6(7) no . . . .
N42 N41 C45 C44 1.1(5) no . . . .
N42 N41 C45 C47 -179.5(4) no . . . .
C45 N41 N42 Ag1 156.8(3) no . . . 2_665
C45 N41 N42 C43 -0.8(5) no . . . .
Ag1 N42 C43 C44 -153.9(3) no 2_665 . . .
Ag1 N42 C43 C46 27.3(6) no 2_665 . . .
N41 N42 C43 C44 0.3(5) no . . . .
N41 N42 C43 C46 -178.6(4) no . . . .
Pt1 C11 C12 C13 179.1(4) no . . . .
Pt1 C11 C12 C22 -3.2(6) no . . . .
Pt1 C11 C16 C15 -178.0(4) no . . . .
C12 C11 C16 C15 1.2(9) no . . . .
C16 C11 C12 C13 -0.2(9) no . . . .
C16 C11 C12 C22 177.6(5) no . . . .
N11 C12 C13 F13 178.3(5) no . . . .
N11 C12 C13 C14 -1.3(9) no . . . .
N11 C12 C22 N21 1.0(8) no . . . .
N11 C12 C22 C21 1.0(8) no . . . .
N11 C12 C22 C23 -178.4(5) no . . . .
C11 C12 C13 F13 178.3(5) no . . . .
C11 C12 C13 C14 -1.3(9) no . . . .
C11 C12 C22 N21 1.0(8) no . . . .
C11 C12 C22 C21 1.0(8) no . . . .
C11 C12 C22 C23 -178.4(5) no . . . .
C13 C12 C22 N21 178.8(6) no . . . .
C13 C12 C22 C21 178.8(6) no . . . .
C13 C12 C22 C23 -0.7(10) no . . . .
C22 C12 C13 F13 0.7(9) no . . . .
C22 C12 C13 C14 -178.9(5) no . . . .
F13 C13 C14 C15 -177.8(6) no . . . .
C12 C13 C14 C15 1.8(10) no . . . .
C13 C14 C15 F15 -178.0(6) no . . . .
C13 C14 C15 C16 -0.9(11) no . . . .
F15 C15 C16 N11 176.1(6) no . . . .
F15 C15 C16 C11 176.1(6) no . . . .
C14 C15 C16 N11 -0.6(11) no . . . .
C14 C15 C16 C11 -0.6(11) no . . . .
Pt1 C21 C22 C12 1.6(6) no . . . .
Pt1 C21 C22 C23 -179.0(4) no . . . .
Pt1 C21 C26 C25 179.8(4) no . . . .
C22 C21 C26 C25 -0.2(9) no . . . .
C26 C21 C22 C12 -178.4(5) no . . . .
C26 C21 C22 C23 1.1(9) no . . . .
N21 C22 C23 F23 176.9(5) no . . . .
N21 C22 C23 C24 -1.9(9) no . . . .
C12 C22 C23 F23 -3.8(9) no . . . .
C12 C22 C23 C24 177.5(5) no . . . .
C21 C22 C23 F23 176.9(5) no . . . .
C21 C22 C23 C24 -1.9(9) no . . . .
F23 C23 C24 C25 -176.6(7) no . . . .
C22 C23 C24 C25 1.8(10) no . . . .
C23 C24 C25 F25 -179.3(6) no . . . .
C23 C24 C25 C26 -1.1(12) no . . . .
F25 C25 C26 N21 178.1(7) no . . . .
F25 C25 C26 C21 178.1(7) no . . . .
C24 C25 C26 N21 0.3(11) no . . . .
C24 C25 C26 C21 0.3(11) no . . . .
N32 C33 C34 C35 0.1(6) no . . . .
C36 C33 C34 C35 180.0(6) no . . . .
C33 C34 C35 N31 0.1(6) no . . . .
C33 C34 C35 C37 -178.0(5) no . . . .
N42 C43 C44 C45 0.4(5) no . . . .
C46 C43 C44 C45 179.1(5) no . . . .
C43 C44 C45 N41 -0.9(5) no . . . .
C43 C44 C45 C47 179.8(4) no . . . .

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
Pt1 Ag1 3.3606(11) no . .
Pt1 Ag1 3.3683(8) no . 2_665
Pt1 C37 3.534(6) no . .
Pt1 C47 3.536(6) no . .
Ag1 Ag1 3.1936(11) no . 2_665
Ag1 N21 3.559(5) no . .
Ag1 C21 3.559(5) no . .
Ag1 C36 3.536(5) no . .
Ag1 C46 3.517(6) no . 2_665
F13 C22 2.843(7) no . .
F13 C23 2.647(9) no . .
F15 C11 3.553(8) no . .
F15 C13 3.478(10) no . .
F23 C12 2.747(9) no . .
F23 C13 2.544(11) no . .
F25 C21 3.547(11) no . .
F25 C23 3.444(11) no . .
N21 N32 3.597(6) no . .
N21 C24 2.769(8) no . .
N11 C14 2.788(7) no . .
N31 N42 3.553(8) no . .
N31 C26 3.103(7) no . .
N32 C21 3.597(6) no . .
N32 C26 3.507(7) no . .
N41 C16 3.110(6) no . .
C11 C14 2.788(7) no . .
C12 C15 2.681(11) no . .
C13 C16 2.799(8) no . .
C13 C23 3.048(11) no . .
C21 C24 2.769(8) no . .
C22 C25 2.667(10) no . .
C23 C26 2.788(7) no . .
Cl1 F15 3.139(6) no . 1_556
Cl1 F23 3.126(6) no . 1_456
Cl1 C37 3.577(6) no . 2_576
Cl2 F13 3.423(7) no . 2_675
Cl2 F23 3.536(9) no . 2_675
Cl2 C12 3.432(7) no . 2_675
Cl2 C13 3.364(7) no . 2_675
F13 Cl2 3.423(7) no . 2_675
F13 C26 3.497(9) no . 2_675
F13 C34 3.576(7) no . 1_564
F13 C36 3.371(9) no . 1_564
F13 C37 3.260(9) no . 2_675
F15 Cl1 3.139(6) no . 1_554
F15 C1 3.583(7) no . 1_554
F15 C24 3.199(8) no . 1_455
F23 Cl1 3.126(6) no . 1_654
F23 Cl2 3.536(9) no . 2_675
F23 C37 3.155(8) no . 2_675
F25 C13 3.555(9) no . 2_675
F25 C14 3.370(12) no . 2_675
F25 C15 3.448(13) no . 2_675
F25 C16 3.359(8) no . 1_655
F25 C44 3.541(9) no . 1_655
F25 C45 3.167(8) no . 1_655
F25 C47 2.929(10) no . 1_655
N21 C23 3.558(8) no . 2_675
N11 C24 3.477(10) no . 2_675
N42 C1 3.512(7) no . 1_545
C1 F15 3.583(7) no . 1_556
C1 N42 3.512(7) no . 1_565
C1 C43 3.462(8) no . 1_565
C11 C24 3.477(10) no . 2_675
C12 Cl2 3.432(7) no . 2_675
C12 C24 3.494(10) no . 2_675
C12 C25 3.497(10) no . 2_675
C13 Cl2 3.364(7) no . 2_675
C13 F25 3.555(9) no . 2_675
C13 C25 3.463(10) no . 2_675
C13 C26 3.593(11) no . 2_675
C14 F25 3.370(12) no . 2_675
C15 F25 3.448(13) no . 2_675
C16 F25 3.359(8) no . 1_455
C21 C23 3.558(8) no . 2_675
C22 C22 3.548(10) no . 2_675
C22 C23 3.584(9) no . 2_675
C23 N21 3.558(8) no . 2_675
C23 C21 3.558(8) no . 2_675
C23 C22 3.584(9) no . 2_675
C24 F15 3.199(8) no . 1_655
C24 N11 3.477(10) no . 2_675
C24 C11 3.477(10) no . 2_675
C24 C12 3.494(10) no . 2_675
C25 C12 3.497(10) no . 2_675
C25 C13 3.463(10) no . 2_675
C26 F13 3.497(9) no . 2_675
C26 C13 3.593(11) no . 2_675
C34 F13 3.576(7) no . 1_546
C36 F13 3.371(9) no . 1_546
C37 Cl1 3.577(6) no . 2_576
C37 F13 3.260(9) no . 2_675
C37 F23 3.155(8) no . 2_675
C43 C1 3.462(8) no . 1_545
C44 F25 3.541(9) no . 1_455
C45 F25 3.167(8) no . 1_455
C47 F25 2.929(10) no . 1_455
Pt1 H16 3.1469 no . .
Pt1 H26 3.1351 no . .
Pt1 H37B 2.9720 no . .
Pt1 H47A 3.1161 no . .
Ag1 H16 3.5590 no . 2_665
Ag1 H26 3.5144 no . .
Ag1 H36B 2.9556 no . .
Ag1 H46B 2.9404 no . 2_665
F13 H14 2.7191 no . .
F15 H14 2.3448 no . .
F15 H16 2.5937 no . .
F15 H36B 3.1172 no . 2_665
F23 H24 2.8174 no . .
F25 H24 2.2764 no . .
F25 H26 2.6094 no . .
F25 H46B 3.2839 no . 2_665
N21 H46B 3.4652 no . 2_665
N11 H36B 3.5891 no . 2_665
N11 H47A 3.4883 no . .
N31 H26 2.5864 no . .
N31 H34 3.1361 no . .
N31 H37A 3.0335 no . .
N31 H37B 2.5385 no . .
N31 H37C 3.1535 no . .
N32 H26 2.9127 no . .
N32 H34 3.1462 no . .
N32 H36A 3.1705 no . .
N32 H36B 2.5460 no . .
N32 H36C 3.0203 no . .
N41 H16 2.6090 no . .
N41 H44 3.1380 no . .
N41 H47A 2.6056 no . .
N41 H47B 2.9034 no . .
N41 H47C 3.2317 no . .
N42 H16 3.0485 no . .
N42 H44 3.1456 no . .
N42 H46A 2.9736 no . .
N42 H46B 2.5413 no . .
N42 H46C 3.1797 no . .
C11 H36B 3.5891 no . 2_665
C11 H47A 3.4883 no . .
C12 H14 3.2689 no . .
C12 H16 3.2602 no . .
C14 H16 3.2674 no . .
C14 H36B 3.5653 no . 2_665
C14 H36C 3.4328 no . 2_665
C15 H36B 2.9451 no . 2_665
C15 H36C 3.4184 no . 2_665
C16 H14 3.2690 no . .
C16 H36B 2.9741 no . 2_665
C16 H47A 3.5223 no . .
C21 H46B 3.4652 no . 2_665
C22 H24 3.2653 no . .
C22 H26 3.2377 no . .
C24 H26 3.2413 no . .
C24 H46A 3.4863 no . 2_665
C24 H46B 3.4031 no . 2_665
C25 H46A 3.5937 no . 2_665
C25 H46B 2.9058 no . 2_665
C26 H24 3.2427 no . .
C26 H46B 2.9537 no . 2_665
C33 H26 3.4306 no . .
C34 H26 3.4922 no . .
C34 H36A 2.8370 no . .
C34 H36B 3.3659 no . .
C34 H36C 2.9847 no . .
C34 H37A 2.9619 no . .
C34 H37B 3.3493 no . .
C34 H37C 2.8230 no . .
C35 H26 2.9851 no . .
C36 H34 2.9575 no . .
C37 H34 2.9438 no . .
C37 H47A 3.5627 no . .
C37 H47B 2.9426 no . .
C43 H16 3.5742 no . .
C44 H16 3.5476 no . .
C44 H46A 2.9981 no . .
C44 H46B 3.3517 no . .
C44 H46C 2.8127 no . .
C44 H47A 3.3131 no . .
C44 H47B 3.0665 no . .
C44 H47C 2.7494 no . .
C45 H16 2.9441 no . .
C46 H44 2.9570 no . .
C47 H16 3.5149 no . .
C47 H37A 3.3056 no . .
C47 H37B 3.1199 no . .
C47 H44 2.9410 no . .
H14 H36C 3.5945 no . 2_665
H16 H36B 3.1032 no . 2_665
H16 H47A 3.1562 no . .
H26 H37B 3.4958 no . .
H26 H46B 3.1753 no . 2_665
H34 H36A 2.9250 no . .
H34 H36C 3.1880 no . .
H34 H37A 3.1582 no . .
H34 H37C 2.9237 no . .
H37A H47A 3.4774 no . .
H37A H47B 2.4496 no . .
H37B H47A 2.8315 no . .
H37B H47B 2.6242 no . .
H44 H46A 3.2292 no . .
H44 H46C 2.8927 no . .
H44 H47B 3.3444 no . .
H44 H47C 2.7843 no . .
Ag1 H46C 3.3524 no . 1_655
Cl1 H36A 3.5462 no . 1_465
Cl1 H37A 3.3833 no . 2_576
Cl1 H37B 3.2128 no . 2_576
Cl1 H37C 3.5525 no . 2_576
Cl1 H46A 3.4965 no . 1_565
Cl1 H47B 3.4075 no . 2_576
Cl2 H14 3.3848 no . 1_556
Cl2 H36C 3.0798 no . 1_565
F13 H26 3.4099 no . 2_675
F13 H34 2.8780 no . 1_564
F13 H36A 2.8098 no . 1_564
F13 H36C 3.2028 no . 1_564
F13 H37B 2.8726 no . 2_675
F13 H37C 2.7892 no . 2_675
F15 H1B 3.3450 no . 1_554
F15 H24 2.5971 no . 1_455
F15 H46A 2.9572 no . 2_565
F15 H46C 3.4618 no . 2_565
F15 H47A 3.3914 no . 2_575
F23 H37B 2.3789 no . 2_675
F23 H37C 3.0986 no . 2_675
F25 H16 2.7107 no . 1_655
F25 H47A 2.8392 no . 1_655
F25 H47C 2.4684 no . 1_655
N11 H24 3.3623 no . 2_675
N31 H1A 3.3388 no . 1_545
N31 H1B 3.3212 no . 1_545
N32 H1A 3.4367 no . 1_545
N32 H1B 3.3168 no . 1_545
N41 H1A 2.8030 no . 1_545
N42 H1A 2.5491 no . 1_545
N42 H46C 3.1556 no . 2_565
C1 H14 3.2077 no . 1_556
C1 H46A 3.4272 no . 1_565
C1 H47B 3.4983 no . 2_576
C11 H24 3.3623 no . 2_675
C13 H34 3.4283 no . 1_564
C13 H36C 3.4908 no . 1_564
C14 H1B 3.3888 no . 1_554
C14 H34 3.3062 no . 1_564
C14 H36C 3.2754 no . 1_564
C14 H47C 3.3070 no . 2_575
C15 H24 3.2567 no . 1_455
C16 H24 3.5550 no . 2_675
C16 H46C 3.2367 no . 2_565
C23 H37B 3.4420 no . 2_675
C24 H47A 3.3256 no . 2_675
C25 H16 3.4996 no . 1_655
C25 H47C 3.4882 no . 1_655
C33 H1B 3.0639 no . 1_545
C33 H14 3.3200 no . 1_546
C33 H37C 3.3040 no . 2_666
C33 H44 3.3332 no . 1_655
C34 H1B 2.9147 no . 1_545
C34 H14 3.0525 no . 1_546
C34 H34 3.4408 no . 2_666
C34 H37C 2.9401 no . 2_666
C34 H47C 3.4138 no . 2_566
C35 H1B 3.0872 no . 1_545
C35 H34 3.4076 no . 2_666
C36 H14 3.3541 no . 1_546
C36 H37C 3.3991 no . 2_666
C36 H44 3.2983 no . 1_655
C36 H46C 3.4130 no . 1_655
C37 H34 3.3102 no . 2_666
C37 H36A 3.5613 no . 2_666
C37 H44 3.1896 no . 2_566
C37 H47B 3.3361 no . 2_566
C37 H47C 3.4892 no . 2_566
C43 H1A 2.5643 no . 1_545
C43 H46B 3.4108 no . 2_565
C43 H46C 3.0247 no . 2_565
C44 H1A 2.8494 no . 1_545
C44 H36A 3.5557 no . 1_455
C44 H37A 3.1027 no . 2_566
C44 H37C 3.3933 no . 2_566
C44 H46B 3.4520 no . 2_565
C44 H46C 3.5714 no . 2_565
C45 H1A 2.9843 no . 1_545
C45 H37A 3.1333 no . 2_566
C46 H1A 3.2786 no . 1_545
C46 H16 3.2035 no . 2_565
C46 H36B 3.2870 no . 1_455
C46 H46C 3.2856 no . 2_565
C47 H1B 3.3654 no . 2_576
C47 H24 3.4726 no . 2_675
C47 H37A 2.8885 no . 2_566
H1A N31 3.3388 no . 1_565
H1A N32 3.4367 no . 1_565
H1A N41 2.8030 no . 1_565
H1A N42 2.5491 no . 1_565
H1A C43 2.5643 no . 1_565
H1A C44 2.8494 no . 1_565
H1A C45 2.9843 no . 1_565
H1A C46 3.2786 no . 1_565
H1A H44 3.4104 no . 1_565
H1A H46A 2.9669 no . 1_565
H1B F15 3.3450 no . 1_556
H1B N31 3.3212 no . 1_565
H1B N32 3.3168 no . 1_565
H1B C14 3.3888 no . 1_556
H1B C33 3.0639 no . 1_565
H1B C34 2.9147 no . 1_565
H1B C35 3.0872 no . 1_565
H1B C47 3.3654 no . 2_576
H1B H14 2.4999 no . 1_556
H1B H34 3.2384 no . 1_565
H1B H36C 3.4511 no . 1_565
H1B H37A 3.5386 no . 1_565
H1B H47B 2.9057 no . 2_576
H1B H47C 3.0788 no . 2_576
H14 Cl2 3.3848 no . 1_554
H14 C1 3.2077 no . 1_554
H14 C33 3.3200 no . 1_564
H14 C34 3.0525 no . 1_564
H14 C36 3.3541 no . 1_564
H14 H1B 2.4999 no . 1_554
H14 H34 2.7017 no . 1_564
H14 H36A 3.5836 no . 1_564
H14 H36C 2.7400 no . 1_564
H14 H47C 2.9345 no . 2_575
H16 F25 2.7107 no . 1_455
H16 C25 3.4996 no . 1_455
H16 C46 3.2035 no . 2_565
H16 H24 3.3809 no . 1_455
H16 H46A 3.2936 no . 2_565
H16 H46B 3.2535 no . 2_565
H16 H46C 2.5796 no . 2_565
H24 F15 2.5971 no . 1_655
H24 N11 3.3623 no . 2_675
H24 C11 3.3623 no . 2_675
H24 C15 3.2567 no . 1_655
H24 C16 3.5550 no . 2_675
H24 C47 3.4726 no . 2_675
H24 H16 3.3809 no . 1_655
H24 H47A 2.5161 no . 2_675
H26 F13 3.4099 no . 2_675
H26 H34 3.3025 no . 2_666
H26 H44 3.0867 no . 1_655
H26 H47C 3.4331 no . 1_655
H34 F13 2.8780 no . 1_546
H34 C13 3.4283 no . 1_546
H34 C14 3.3062 no . 1_546
H34 C34 3.4408 no . 2_666
H34 C35 3.4076 no . 2_666
H34 C37 3.3102 no . 2_666
H34 H1B 3.2384 no . 1_545
H34 H14 2.7017 no . 1_546
H34 H26 3.3025 no . 2_666
H34 H34 3.3289 no . 2_666
H34 H37C 2.5309 no . 2_666
H34 H47C 2.9783 no . 2_566
H36A Cl1 3.5462 no . 1_645
H36A F13 2.8098 no . 1_546
H36A C37 3.5613 no . 2_666
H36A C44 3.5557 no . 1_655
H36A H14 3.5836 no . 1_546
H36A H37C 2.6712 no . 2_666
H36A H44 2.8417 no . 1_655
H36A H46A 3.3970 no . 1_655
H36A H46C 3.4177 no . 1_655
H36B C46 3.2870 no . 1_655
H36B H44 3.2748 no . 1_655
H36B H46A 3.1546 no . 1_655
H36B H46C 2.6205 no . 1_655
H36C Cl2 3.0798 no . 1_545
H36C F13 3.2028 no . 1_546
H36C C13 3.4908 no . 1_546
H36C C14 3.2754 no . 1_546
H36C H1B 3.4511 no . 1_545
H36C H14 2.7400 no . 1_546
H36C H36C 3.5386 no . 2_656
H37A Cl1 3.3833 no . 2_576
H37A C44 3.1027 no . 2_566
H37A C45 3.1333 no . 2_566
H37A C47 2.8885 no . 2_566
H37A H1B 3.5386 no . 1_545
H37A H44 2.8003 no . 2_566
H37A H47B 2.4193 no . 2_566
H37A H47C 2.8110 no . 2_566
H37B Cl1 3.2128 no . 2_576
H37B F13 2.8726 no . 2_675
H37B F23 2.3789 no . 2_675
H37B C23 3.4420 no . 2_675
H37C Cl1 3.5525 no . 2_576
H37C F13 2.7892 no . 2_675
H37C F23 3.0986 no . 2_675
H37C C33 3.3040 no . 2_666
H37C C34 2.9401 no . 2_666
H37C C36 3.3991 no . 2_666
H37C C44 3.3933 no . 2_566
H37C H34 2.5309 no . 2_666
H37C H36A 2.6712 no . 2_666
H37C H44 2.6914 no . 2_566
H44 C33 3.3332 no . 1_455
H44 C36 3.2983 no . 1_455
H44 C37 3.1896 no . 2_566
H44 H1A 3.4104 no . 1_545
H44 H26 3.0867 no . 1_455
H44 H36A 2.8417 no . 1_455
H44 H36B 3.2748 no . 1_455
H44 H37A 2.8003 no . 2_566
H44 H37C 2.6914 no . 2_566
H44 H46B 3.5358 no . 2_565
H46A Cl1 3.4965 no . 1_545
H46A F15 2.9572 no . 2_565
H46A C1 3.4272 no . 1_545
H46A H1A 2.9669 no . 1_545
H46A H16 3.2936 no . 2_565
H46A H36A 3.3970 no . 1_455
H46A H36B 3.1546 no . 1_455
H46B C43 3.4108 no . 2_565
H46B C44 3.4520 no . 2_565
H46B H16 3.2535 no . 2_565
H46B H44 3.5358 no . 2_565
H46B H46C 3.1266 no . 2_565
H46C Ag1 3.3524 no . 1_455
H46C F15 3.4618 no . 2_565
H46C N42 3.1556 no . 2_565
H46C C16 3.2367 no . 2_565
H46C C36 3.4130 no . 1_455
H46C C43 3.0247 no . 2_565
H46C C44 3.5714 no . 2_565
H46C C46 3.2856 no . 2_565
H46C H16 2.5796 no . 2_565
H46C H36A 3.4177 no . 1_455
H46C H36B 2.6205 no . 1_455
H46C H46B 3.1266 no . 2_565
H46C H46C 3.1389 no . 2_565
H47A F15 3.3914 no . 2_575
H47A F25 2.8392 no . 1_455
H47A C24 3.3256 no . 2_675
H47A H24 2.5161 no . 2_675
H47B Cl1 3.4075 no . 2_576
H47B C1 3.4983 no . 2_576
H47B C37 3.3361 no . 2_566
H47B H1B 2.9057 no . 2_576
H47B H37A 2.4193 no . 2_566
H47B H47B 3.1818 no . 2_566
H47C F25 2.4684 no . 1_455
H47C C14 3.3070 no . 2_575
H47C C25 3.4882 no . 1_455
H47C C34 3.4138 no . 2_566
H47C C37 3.4892 no . 2_566
H47C H1B 3.0788 no . 2_576
H47C H14 2.9345 no . 2_575
H47C H26 3.4331 no . 1_455
H47C H34 2.9783 no . 2_566
H47C H37A 2.8110 no . 2_566
_chemical_name_systematic        '[Pt2Ag2(dfppy)2(Me2pz)4]'
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: dichloromethane/n-hexane'
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_2c
_database_code_depnum_ccdc_archive 'CCDC 1438723'
_audit_update_record             
;
2015-11-25 deposited with the CCDC.
2016-02-22 downloaded from the CCDC.
;
#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C46 H44 Ag2 N10 Pt2'
_chemical_formula_moiety         'C46 H44 Ag2 N10 Pt2'
_chemical_formula_weight         1342.84
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_Int_Tables_number      14
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +X,+Y,+Z
2 1/2-X,1/2+Y,1/2-Z
3 -X,-Y,-Z
4 1/2+X,1/2-Y,1/2+Z
#------------------------------------------------------------------------------
_cell_length_a                   11.7400(14)
_cell_length_b                   16.500(2)
_cell_length_c                   21.910(3)
_cell_angle_alpha                90.0000
_cell_angle_beta                 92.4600(19)
_cell_angle_gamma                90.0000
_cell_volume                     4240.3(9)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    11806
_cell_measurement_theta_min      3.02
_cell_measurement_theta_max      27.48
_cell_measurement_temperature    93
#------------------------------------------------------------------------------
_exptl_crystal_description       prism
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.060
_exptl_crystal_size_mid          0.060
_exptl_crystal_size_min          0.030
_exptl_crystal_density_diffrn    2.103
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2560.00
_exptl_absorpt_coefficient_mu    7.506
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_absorpt_correction_T_min  0.642
_exptl_absorpt_correction_T_max  0.798

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      93
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku Saturn724'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 7.111
_diffrn_reflns_number            34852
_diffrn_reflns_av_R_equivalents  0.0380
_diffrn_reflns_av_sigmaI/netI    0.0409
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_full        27.49
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       26
_diffrn_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             9717
_reflns_number_gt                8654
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0374
_refine_ls_wR_factor_ref         0.0676
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         9717
_refine_ls_number_parameters     549
_refine_ls_goodness_of_fit_ref   1.130
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0145P)²+19.9767P] 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_diff_density_max         2.130
_refine_diff_density_min         -1.140
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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 for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.4)
;
Ag Ag -0.8971 1.1015
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
N N 0.0061 0.0033
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Pt Pt -1.7033 8.3905
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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 0.219258(17) 0.265904(12) 0.372341(9) 0.01424(5) Uani 1.0 4 d . . .
Pt2 Pt 0.521788(17) 0.291823(12) 0.594546(9) 0.01362(5) Uani 1.0 4 d . . .
Ag1 Ag 0.25778(3) 0.24850(2) 0.539463(19) 0.01691(9) Uani 1.0 4 d . . .
Ag2 Ag 0.43982(3) 0.17545(2) 0.456905(19) 0.01632(9) Uani 1.0 4 d . . .
N1 N 0.3318(4) 0.2276(3) 0.3136(3) 0.0171(11) Uani 0.5000 4 d . . .
N10 N 0.2519(4) 0.3750(3) 0.3331(2) 0.0121(10) Uani 0.5000 4 d . . .
N30 N 0.5722(4) 0.4056(3) 0.5718(2) 0.0114(10) Uani 0.5000 4 d . . .
N21 N 0.4192(5) 0.3524(4) 0.6483(3) 0.0222(12) Uani 0.5000 4 d . . .
N41 N 0.1064(4) 0.3158(3) 0.4338(2) 0.0146(9) Uani 1.0 4 d . . .
N42 N 0.1421(4) 0.3263(3) 0.4933(2) 0.0152(9) Uani 1.0 4 d . . .
N51 N 0.1978(4) 0.1535(3) 0.4065(2) 0.0173(10) Uani 1.0 4 d . . .
N52 N 0.2892(4) 0.1148(3) 0.4345(2) 0.0180(10) Uani 1.0 4 d . . .
N61 N 0.6374(4) 0.2387(3) 0.5364(2) 0.0144(9) Uani 1.0 4 d . . .
N62 N 0.6031(4) 0.2185(3) 0.4778(2) 0.0154(10) Uani 1.0 4 d . . .
N71 N 0.4563(4) 0.1845(3) 0.61712(19) 0.0137(9) Uani 1.0 4 d . . .
N72 N 0.3470(4) 0.1655(3) 0.5958(2) 0.0153(10) Uani 1.0 4 d . . .
C1 C 0.3318(4) 0.2276(3) 0.3136(3) 0.0171(11) Uani 0.5000 4 d . . .
C2 C 0.3755(5) 0.1509(4) 0.3015(3) 0.0196(12) Uani 1.0 4 d . . .
C3 C 0.4601(5) 0.1392(4) 0.2591(3) 0.0235(13) Uani 1.0 4 d . . .
C4 C 0.5055(5) 0.2035(4) 0.2276(3) 0.0228(13) Uani 1.0 4 d . . .
C5 C 0.5038(5) 0.3520(4) 0.2064(3) 0.0241(13) Uani 1.0 4 d . . .
C6 C 0.4602(5) 0.4262(4) 0.2161(3) 0.0235(13) Uani 1.0 4 d . . .
C7 C 0.3248(5) 0.5137(4) 0.2723(3) 0.0202(12) Uani 1.0 4 d . . .
C8 C 0.2418(5) 0.5179(4) 0.3149(3) 0.0213(13) Uani 1.0 4 d . . .
C9 C 0.2077(5) 0.4476(4) 0.3445(3) 0.0184(12) Uani 1.0 4 d . . .
C10 C 0.2519(4) 0.3750(3) 0.3331(2) 0.0121(10) Uani 0.5000 4 d . . .
C11 C 0.3336(5) 0.3706(4) 0.2900(3) 0.0201(12) Uani 1.0 4 d . . .
C12 C 0.3786(5) 0.2923(4) 0.2795(3) 0.0174(12) Uani 1.0 4 d . . .
C13 C 0.4647(5) 0.2814(4) 0.2368(3) 0.0188(12) Uani 1.0 4 d . . .
C14 C 0.3728(5) 0.4385(4) 0.2585(3) 0.0198(12) Uani 1.0 4 d . . .
C21 C 0.4192(5) 0.3524(4) 0.6483(3) 0.0222(12) Uani 0.5000 4 d . . .
C22 C 0.3439(5) 0.3286(4) 0.6922(3) 0.0201(12) Uani 1.0 4 d . . .
C23 C 0.2802(5) 0.3854(4) 0.7241(3) 0.0230(13) Uani 1.0 4 d . . .
C24 C 0.2878(5) 0.4665(4) 0.7131(3) 0.0221(13) Uani 1.0 4 d . . .
C25 C 0.3744(5) 0.5799(4) 0.6547(3) 0.0213(13) Uani 1.0 4 d . . .
C26 C 0.4526(5) 0.6044(4) 0.6140(3) 0.0191(12) Uani 1.0 4 d . . .
C27 C 0.6087(5) 0.5684(4) 0.5441(3) 0.0201(13) Uani 1.0 4 d . . .
C28 C 0.6730(5) 0.5082(4) 0.5188(3) 0.0178(12) Uani 1.0 4 d . . .
C29 C 0.6530(5) 0.4270(4) 0.5335(3) 0.0180(12) Uani 1.0 4 d . . .
C30 C 0.5722(4) 0.4056(3) 0.5718(2) 0.0114(10) Uani 0.5000 4 d . . .
C31 C 0.5089(5) 0.4646(4) 0.5980(3) 0.0161(11) Uani 1.0 4 d . . .
C32 C 0.4274(5) 0.4381(4) 0.6392(3) 0.0167(11) Uani 1.0 4 d . . .
C33 C 0.3610(5) 0.4957(4) 0.6693(3) 0.0195(12) Uani 1.0 4 d . . .
C34 C 0.5247(5) 0.5480(4) 0.5850(3) 0.0190(12) Uani 1.0 4 d . . .
C43 C 0.0665(5) 0.3753(4) 0.5197(3) 0.0179(12) Uani 1.0 4 d . . .
C44 C -0.0186(5) 0.3965(4) 0.4768(3) 0.0208(13) Uani 1.0 4 d . . .
C45 C 0.0093(5) 0.3570(4) 0.4235(3) 0.0174(12) Uani 1.0 4 d . . .
C46 C 0.0833(6) 0.4010(4) 0.5851(3) 0.0256(13) Uani 1.0 4 d . . .
C47 C -0.0529(5) 0.3569(4) 0.3617(3) 0.0270(14) Uani 1.0 4 d . . .
C53 C 0.2585(5) 0.0376(3) 0.4445(3) 0.0174(12) Uani 1.0 4 d . . .
C54 C 0.1466(5) 0.0269(4) 0.4231(3) 0.0203(12) Uani 1.0 4 d . . .
C55 C 0.1109(5) 0.1019(4) 0.3989(3) 0.0178(12) Uani 1.0 4 d . . .
C56 C 0.3415(5) -0.0208(4) 0.4725(3) 0.0221(13) Uani 1.0 4 d . . .
C57 C 0.0009(5) 0.1280(4) 0.3681(3) 0.0251(14) Uani 1.0 4 d . . .
C63 C 0.6967(5) 0.2058(3) 0.4459(3) 0.0156(11) Uani 1.0 4 d . . .
C64 C 0.7932(5) 0.2197(4) 0.4836(3) 0.0189(12) Uani 1.0 4 d . . .
C65 C 0.7520(5) 0.2396(4) 0.5402(3) 0.0166(11) Uani 1.0 4 d . . .
C66 C 0.6862(5) 0.1812(4) 0.3800(3) 0.0206(12) Uani 1.0 4 d . . .
C67 C 0.8164(5) 0.2618(4) 0.5974(3) 0.0247(13) Uani 1.0 4 d . . .
C73 C 0.3217(5) 0.0919(4) 0.6170(3) 0.0177(12) Uani 1.0 4 d . . .
C74 C 0.4121(5) 0.0628(4) 0.6531(3) 0.0219(13) Uani 1.0 4 d . . .
C75 C 0.4961(5) 0.1225(4) 0.6521(3) 0.0191(12) Uani 1.0 4 d . . .
C76 C 0.2081(5) 0.0535(4) 0.6024(3) 0.0237(13) Uani 1.0 4 d . . .
C77 C 0.6118(6) 0.1257(4) 0.6830(3) 0.0309(15) Uani 1.0 4 d . . .
H2 H 0.3472 0.1053 0.3226 0.0235 Uiso 1.0 4 calc R . .
H3 H 0.4868 0.0858 0.2517 0.0282 Uiso 1.0 4 calc R . .
H4 H 0.5642 0.1944 0.1999 0.0274 Uiso 1.0 4 calc R . .
H5 H 0.5626 0.3464 0.1782 0.0289 Uiso 1.0 4 calc R . .
H6 H 0.4882 0.4713 0.1944 0.0282 Uiso 1.0 4 calc R . .
H7 H 0.3493 0.5615 0.2526 0.0243 Uiso 1.0 4 calc R . .
H8 H 0.2079 0.5685 0.3240 0.0256 Uiso 1.0 4 calc R . .
H9 H 0.1508 0.4516 0.3739 0.0221 Uiso 1.0 4 calc R . .
H22 H 0.3353 0.2726 0.7008 0.0241 Uiso 1.0 4 calc R . .
H23 H 0.2304 0.3669 0.7542 0.0276 Uiso 1.0 4 calc R . .
H24 H 0.2433 0.5035 0.7353 0.0266 Uiso 1.0 4 calc R . .
H25 H 0.3283 0.6191 0.6736 0.0256 Uiso 1.0 4 calc R . .
H26 H 0.4590 0.6605 0.6049 0.0229 Uiso 1.0 4 calc R . .
H27 H 0.6212 0.6235 0.5338 0.0242 Uiso 1.0 4 calc R . .
H28 H 0.7308 0.5218 0.4915 0.0213 Uiso 1.0 4 calc R . .
H29 H 0.6978 0.3860 0.5158 0.0216 Uiso 1.0 4 calc R . .
H44 H -0.0823 0.4307 0.4826 0.0250 Uiso 1.0 4 calc R . .
H46A H 0.0987 0.4594 0.5868 0.0307 Uiso 1.0 4 calc R . .
H46B H 0.1480 0.3715 0.6041 0.0307 Uiso 1.0 4 calc R . .
H46C H 0.0143 0.3890 0.6070 0.0307 Uiso 1.0 4 calc R . .
H47A H -0.1273 0.3307 0.3650 0.0325 Uiso 1.0 4 calc R . .
H47B H -0.0079 0.3271 0.3325 0.0325 Uiso 1.0 4 calc R . .
H47C H -0.0637 0.4128 0.3476 0.0325 Uiso 1.0 4 calc R . .
H54 H 0.1029 -0.0215 0.4246 0.0243 Uiso 1.0 4 calc R . .
H56A H 0.3774 0.0031 0.5095 0.0265 Uiso 1.0 4 calc R . .
H56B H 0.4002 -0.0332 0.4434 0.0265 Uiso 1.0 4 calc R . .
H56C H 0.3018 -0.0707 0.4831 0.0265 Uiso 1.0 4 calc R . .
H57A H 0.0088 0.1283 0.3237 0.0301 Uiso 1.0 4 calc R . .
H57B H -0.0184 0.1826 0.3818 0.0301 Uiso 1.0 4 calc R . .
H57C H -0.0597 0.0902 0.3785 0.0301 Uiso 1.0 4 calc R . .
H64 H 0.8706 0.2162 0.4729 0.0227 Uiso 1.0 4 calc R . .
H66A H 0.6129 0.2000 0.3621 0.0247 Uiso 1.0 4 calc R . .
H66B H 0.6904 0.1221 0.3769 0.0247 Uiso 1.0 4 calc R . .
H66C H 0.7484 0.2056 0.3578 0.0247 Uiso 1.0 4 calc R . .
H67A H 0.7651 0.2609 0.6315 0.0297 Uiso 1.0 4 calc R . .
H67B H 0.8482 0.3164 0.5933 0.0297 Uiso 1.0 4 calc R . .
H67C H 0.8784 0.2230 0.6052 0.0297 Uiso 1.0 4 calc R . .
H74 H 0.4162 0.0125 0.6741 0.0263 Uiso 1.0 4 calc R . .
H76A H 0.2180 0.0071 0.5752 0.0285 Uiso 1.0 4 calc R . .
H76B H 0.1572 0.0932 0.5822 0.0285 Uiso 1.0 4 calc R . .
H76C H 0.1749 0.0350 0.6402 0.0285 Uiso 1.0 4 calc R . .
H77A H 0.6226 0.1783 0.7032 0.0371 Uiso 1.0 4 calc R . .
H77B H 0.6698 0.1187 0.6525 0.0371 Uiso 1.0 4 calc R . .
H77C H 0.6191 0.0823 0.7134 0.0371 Uiso 1.0 4 calc R . .



#==============================================================================
_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
_computing_cell_refinement       CrystalClear
_computing_data_reduction        CrystalClear
_computing_structure_solution    'Il Milione (Burla, et al., 2007)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_publication_material  'CrystalStructure 4.0 (Rigaku, 2010)'
_computing_molecular_graphics    'CrystalStructure 4.0'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Pt1 N1 1.987(5) yes . .
Pt1 N10 2.038(5) yes . .
Pt1 N41 2.097(5) yes . .
Pt1 N51 2.019(5) yes . .
Pt1 C1 1.987(5) yes . .
Pt1 C10 2.038(5) yes . .
Pt2 N30 2.036(5) yes . .
Pt2 N21 1.989(6) yes . .
Pt2 N61 2.093(5) yes . .
Pt2 N71 2.002(5) yes . .
Pt2 C21 1.989(6) yes . .
Pt2 C30 2.036(5) yes . .
Ag1 N42 2.097(5) yes . .
Ag1 N72 2.094(5) yes . .
Ag2 N52 2.072(5) yes . .
Ag2 N62 2.077(5) yes . .
N1 C2 1.395(8) yes . .
N1 C12 1.427(8) yes . .
N10 C9 1.334(7) yes . .
N10 C11 1.377(8) yes . .
N30 C29 1.341(7) yes . .
N30 C31 1.366(7) yes . .
N21 C22 1.391(8) yes . .
N21 C32 1.432(8) yes . .
N41 N42 1.365(6) yes . .
N41 C45 1.338(7) yes . .
N42 C43 1.349(7) yes . .
N51 N52 1.371(7) yes . .
N51 C55 1.335(7) yes . .
N52 C53 1.345(7) yes . .
N61 N62 1.371(6) yes . .
N61 C65 1.345(7) yes . .
N62 C63 1.344(7) yes . .
N71 N72 1.383(6) yes . .
N71 C75 1.350(7) yes . .
N72 C73 1.338(7) yes . .
C1 C2 1.395(8) yes . .
C1 C12 1.427(8) yes . .
C2 C3 1.402(9) yes . .
C3 C4 1.385(9) yes . .
C4 C13 1.390(8) yes . .
C5 C6 1.348(9) yes . .
C5 C13 1.429(9) yes . .
C6 C14 1.427(9) yes . .
C7 C8 1.378(9) yes . .
C7 C14 1.401(8) yes . .
C8 C9 1.397(8) yes . .
C9 C10 1.334(7) yes . .
C10 C11 1.377(8) yes . .
C11 C12 1.419(8) yes . .
C11 C14 1.403(8) yes . .
C12 C13 1.418(8) yes . .
C21 C22 1.391(8) yes . .
C21 C32 1.432(8) yes . .
C22 C23 1.405(9) yes . .
C23 C24 1.363(9) yes . .
C24 C33 1.402(8) yes . .
C25 C26 1.367(8) yes . .
C25 C33 1.436(8) yes . .
C26 C34 1.427(8) yes . .
C27 C28 1.377(8) yes . .
C27 C34 1.403(8) yes . .
C28 C29 1.400(8) yes . .
C29 C30 1.341(7) yes . .
C30 C31 1.366(7) yes . .
C31 C32 1.413(8) yes . .
C31 C34 1.419(8) yes . .
C32 C33 1.410(8) yes . .
C43 C44 1.387(8) yes . .
C43 C46 1.498(8) yes . .
C44 C45 1.389(8) yes . .
C45 C47 1.510(9) yes . .
C53 C54 1.386(8) yes . .
C53 C56 1.484(8) yes . .
C54 C55 1.403(8) yes . .
C55 C57 1.494(8) yes . .
C63 C64 1.392(8) yes . .
C63 C66 1.500(8) yes . .
C64 C65 1.391(8) yes . .
C65 C67 1.480(8) yes . .
C73 C74 1.381(8) yes . .
C73 C76 1.499(8) yes . .
C74 C75 1.394(8) yes . .
C75 C77 1.492(9) yes . .
C2 H2 0.950 no . .
C3 H3 0.950 no . .
C4 H4 0.950 no . .
C5 H5 0.950 no . .
C6 H6 0.950 no . .
C7 H7 0.950 no . .
C8 H8 0.950 no . .
C9 H9 0.950 no . .
C22 H22 0.950 no . .
C23 H23 0.950 no . .
C24 H24 0.950 no . .
C25 H25 0.950 no . .
C26 H26 0.950 no . .
C27 H27 0.950 no . .
C28 H28 0.950 no . .
C29 H29 0.950 no . .
C44 H44 0.950 no . .
C46 H46A 0.980 no . .
C46 H46B 0.980 no . .
C46 H46C 0.980 no . .
C47 H47A 0.980 no . .
C47 H47B 0.980 no . .
C47 H47C 0.980 no . .
C54 H54 0.950 no . .
C56 H56A 0.980 no . .
C56 H56B 0.980 no . .
C56 H56C 0.980 no . .
C57 H57A 0.980 no . .
C57 H57B 0.980 no . .
C57 H57C 0.980 no . .
C64 H64 0.950 no . .
C66 H66A 0.980 no . .
C66 H66B 0.980 no . .
C66 H66C 0.980 no . .
C67 H67A 0.980 no . .
C67 H67B 0.980 no . .
C67 H67C 0.980 no . .
C74 H74 0.950 no . .
C76 H76A 0.980 no . .
C76 H76B 0.980 no . .
C76 H76C 0.980 no . .
C77 H77A 0.980 no . .
C77 H77B 0.980 no . .
C77 H77C 0.980 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
N1 Pt1 N41 175.33(19) yes . . .
N1 Pt1 N51 92.6(2) yes . . .
N1 Pt1 C10 82.3(2) yes . . .
N10 Pt1 N41 93.41(18) yes . . .
N10 Pt1 N51 174.83(18) yes . . .
N10 Pt1 C1 82.3(2) yes . . .
N41 Pt1 N51 91.73(18) yes . . .
N41 Pt1 C1 175.33(19) yes . . .
N41 Pt1 C10 93.41(18) yes . . .
N51 Pt1 C1 92.6(2) yes . . .
N51 Pt1 C10 174.83(18) yes . . .
N30 Pt2 N61 91.99(18) yes . . .
N30 Pt2 N71 174.23(18) yes . . .
N30 Pt2 C21 82.6(2) yes . . .
N21 Pt2 N61 174.55(19) yes . . .
N21 Pt2 N71 92.8(2) yes . . .
N21 Pt2 C30 82.6(2) yes . . .
N61 Pt2 N71 92.59(17) yes . . .
N61 Pt2 C21 174.55(19) yes . . .
N61 Pt2 C30 91.99(18) yes . . .
N71 Pt2 C21 92.8(2) yes . . .
N71 Pt2 C30 174.23(18) yes . . .
N42 Ag1 N72 169.05(17) yes . . .
N52 Ag2 N62 170.91(17) yes . . .
Pt1 N1 C2 132.2(4) yes . . .
Pt1 N1 C12 112.5(4) yes . . .
C2 N1 C12 115.2(5) yes . . .
Pt1 N10 C9 129.2(4) yes . . .
Pt1 N10 C11 113.1(4) yes . . .
C9 N10 C11 117.6(5) yes . . .
Pt2 N30 C29 128.1(4) yes . . .
Pt2 N30 C31 112.6(4) yes . . .
C29 N30 C31 119.2(5) yes . . .
Pt2 N21 C22 133.4(5) yes . . .
Pt2 N21 C32 111.6(4) yes . . .
C22 N21 C32 115.0(5) yes . . .
Pt1 N41 N42 119.2(3) yes . . .
Pt1 N41 C45 130.5(4) yes . . .
N42 N41 C45 108.7(5) yes . . .
Ag1 N42 N41 123.3(4) yes . . .
Ag1 N42 C43 125.8(4) yes . . .
N41 N42 C43 107.8(4) yes . . .
Pt1 N51 N52 119.1(4) yes . . .
Pt1 N51 C55 130.3(4) yes . . .
N52 N51 C55 109.8(5) yes . . .
Ag2 N52 N51 121.6(4) yes . . .
Ag2 N52 C53 130.6(4) yes . . .
N51 N52 C53 107.7(5) yes . . .
Pt2 N61 N62 120.0(4) yes . . .
Pt2 N61 C65 129.1(4) yes . . .
N62 N61 C65 108.3(5) yes . . .
Ag2 N62 N61 121.4(4) yes . . .
Ag2 N62 C63 126.8(4) yes . . .
N61 N62 C63 108.2(4) yes . . .
Pt2 N71 N72 118.5(3) yes . . .
Pt2 N71 C75 133.1(4) yes . . .
N72 N71 C75 108.3(5) yes . . .
Ag1 N72 N71 119.0(4) yes . . .
Ag1 N72 C73 133.3(4) yes . . .
N71 N72 C73 107.7(4) yes . . .
Pt1 C1 C2 132.2(4) yes . . .
Pt1 C1 C12 112.5(4) yes . . .
C2 C1 C12 115.2(5) yes . . .
N1 C2 C3 121.8(5) yes . . .
C1 C2 C3 121.8(5) yes . . .
C2 C3 C4 121.6(6) yes . . .
C3 C4 C13 119.6(6) yes . . .
C6 C5 C13 122.3(6) yes . . .
C5 C6 C14 121.4(6) yes . . .
C8 C7 C14 119.6(6) yes . . .
C7 C8 C9 119.8(6) yes . . .
N10 C9 C8 122.5(6) yes . . .
C8 C9 C10 122.5(6) yes . . .
Pt1 C10 C9 129.2(4) yes . . .
Pt1 C10 C11 113.1(4) yes . . .
C9 C10 C11 117.6(5) yes . . .
N10 C11 C12 115.7(5) yes . . .
N10 C11 C14 123.3(5) yes . . .
C10 C11 C12 115.7(5) yes . . .
C10 C11 C14 123.3(5) yes . . .
C12 C11 C14 121.0(5) yes . . .
N1 C12 C11 116.3(5) yes . . .
N1 C12 C13 123.5(5) yes . . .
C1 C12 C11 116.3(5) yes . . .
C1 C12 C13 123.5(5) yes . . .
C11 C12 C13 120.2(5) yes . . .
C4 C13 C5 124.5(6) yes . . .
C4 C13 C12 118.3(5) yes . . .
C5 C13 C12 117.2(5) yes . . .
C6 C14 C7 125.0(6) yes . . .
C6 C14 C11 117.8(5) yes . . .
C7 C14 C11 117.2(5) yes . . .
Pt2 C21 C22 133.4(5) yes . . .
Pt2 C21 C32 111.6(4) yes . . .
C22 C21 C32 115.0(5) yes . . .
N21 C22 C23 121.6(6) yes . . .
C21 C22 C23 121.6(6) yes . . .
C22 C23 C24 121.8(6) yes . . .
C23 C24 C33 120.3(6) yes . . .
C26 C25 C33 121.0(5) yes . . .
C25 C26 C34 121.6(5) yes . . .
C28 C27 C34 119.8(5) yes . . .
C27 C28 C29 119.8(5) yes . . .
N30 C29 C28 121.8(5) yes . . .
C28 C29 C30 121.8(5) yes . . .
Pt2 C30 C29 128.1(4) yes . . .
Pt2 C30 C31 112.6(4) yes . . .
C29 C30 C31 119.2(5) yes . . .
N30 C31 C32 116.4(5) yes . . .
N30 C31 C34 121.9(5) yes . . .
C30 C31 C32 116.4(5) yes . . .
C30 C31 C34 121.9(5) yes . . .
C32 C31 C34 121.7(5) yes . . .
N21 C32 C31 116.5(5) yes . . .
N21 C32 C33 124.0(5) yes . . .
C21 C32 C31 116.5(5) yes . . .
C21 C32 C33 124.0(5) yes . . .
C31 C32 C33 119.6(5) yes . . .
C24 C33 C25 124.1(6) yes . . .
C24 C33 C32 117.2(6) yes . . .
C25 C33 C32 118.7(5) yes . . .
C26 C34 C27 125.1(5) yes . . .
C26 C34 C31 117.3(5) yes . . .
C27 C34 C31 117.5(5) yes . . .
N42 C43 C44 109.2(5) yes . . .
N42 C43 C46 121.2(5) yes . . .
C44 C43 C46 129.6(5) yes . . .
C43 C44 C45 105.2(5) yes . . .
N41 C45 C44 109.1(5) yes . . .
N41 C45 C47 121.7(5) yes . . .
C44 C45 C47 129.2(5) yes . . .
N52 C53 C54 108.8(5) yes . . .
N52 C53 C56 120.4(5) yes . . .
C54 C53 C56 130.8(5) yes . . .
C53 C54 C55 106.2(5) yes . . .
N51 C55 C54 107.5(5) yes . . .
N51 C55 C57 120.9(5) yes . . .
C54 C55 C57 131.6(5) yes . . .
N62 C63 C64 109.2(5) yes . . .
N62 C63 C66 120.5(5) yes . . .
C64 C63 C66 130.3(5) yes . . .
C63 C64 C65 105.3(5) yes . . .
N61 C65 C64 109.1(5) yes . . .
N61 C65 C67 121.9(5) yes . . .
C64 C65 C67 129.0(5) yes . . .
N72 C73 C74 109.8(5) yes . . .
N72 C73 C76 121.2(5) yes . . .
C74 C73 C76 129.0(5) yes . . .
C73 C74 C75 105.8(5) yes . . .
N71 C75 C74 108.4(5) yes . . .
N71 C75 C77 121.1(5) yes . . .
C74 C75 C77 130.5(6) yes . . .
N1 C2 H2 119.088 no . . .
C1 C2 H2 119.088 no . . .
C3 C2 H2 119.079 no . . .
C2 C3 H3 119.217 no . . .
C4 C3 H3 119.217 no . . .
C3 C4 H4 120.206 no . . .
C13 C4 H4 120.216 no . . .
C6 C5 H5 118.831 no . . .
C13 C5 H5 118.825 no . . .
C5 C6 H6 119.298 no . . .
C14 C6 H6 119.294 no . . .
C8 C7 H7 120.196 no . . .
C14 C7 H7 120.213 no . . .
C7 C8 H8 120.088 no . . .
C9 C8 H8 120.081 no . . .
N10 C9 H9 118.750 no . . .
C8 C9 H9 118.743 no . . .
C10 C9 H9 118.750 no . . .
N21 C22 H22 119.170 no . . .
C21 C22 H22 119.170 no . . .
C23 C22 H22 119.192 no . . .
C22 C23 H23 119.103 no . . .
C24 C23 H23 119.109 no . . .
C23 C24 H24 119.833 no . . .
C33 C24 H24 119.841 no . . .
C26 C25 H25 119.524 no . . .
C33 C25 H25 119.517 no . . .
C25 C26 H26 119.177 no . . .
C34 C26 H26 119.176 no . . .
C28 C27 H27 120.111 no . . .
C34 C27 H27 120.101 no . . .
C27 C28 H28 120.108 no . . .
C29 C28 H28 120.104 no . . .
N30 C29 H29 119.102 no . . .
C28 C29 H29 119.118 no . . .
C30 C29 H29 119.102 no . . .
C43 C44 H44 127.380 no . . .
C45 C44 H44 127.389 no . . .
C43 C46 H46A 109.477 no . . .
C43 C46 H46B 109.475 no . . .
C43 C46 H46C 109.476 no . . .
H46A C46 H46B 109.472 no . . .
H46A C46 H46C 109.460 no . . .
H46B C46 H46C 109.468 no . . .
C45 C47 H47A 109.475 no . . .
C45 C47 H47B 109.475 no . . .
C45 C47 H47C 109.475 no . . .
H47A C47 H47B 109.466 no . . .
H47A C47 H47C 109.472 no . . .
H47B C47 H47C 109.465 no . . .
C53 C54 H54 126.878 no . . .
C55 C54 H54 126.872 no . . .
C53 C56 H56A 109.467 no . . .
C53 C56 H56B 109.461 no . . .
C53 C56 H56C 109.471 no . . .
H56A C56 H56B 109.472 no . . .
H56A C56 H56C 109.486 no . . .
H56B C56 H56C 109.470 no . . .
C55 C57 H57A 109.471 no . . .
C55 C57 H57B 109.472 no . . .
C55 C57 H57C 109.475 no . . .
H57A C57 H57B 109.461 no . . .
H57A C57 H57C 109.474 no . . .
H57B C57 H57C 109.475 no . . .
C63 C64 H64 127.367 no . . .
C65 C64 H64 127.363 no . . .
C63 C66 H66A 109.471 no . . .
C63 C66 H66B 109.457 no . . .
C63 C66 H66C 109.468 no . . .
H66A C66 H66B 109.482 no . . .
H66A C66 H66C 109.477 no . . .
H66B C66 H66C 109.473 no . . .
C65 C67 H67A 109.478 no . . .
C65 C67 H67B 109.476 no . . .
C65 C67 H67C 109.476 no . . .
H67A C67 H67B 109.470 no . . .
H67A C67 H67C 109.454 no . . .
H67B C67 H67C 109.474 no . . .
C73 C74 H74 127.082 no . . .
C75 C74 H74 127.087 no . . .
C73 C76 H76A 109.472 no . . .
C73 C76 H76B 109.465 no . . .
C73 C76 H76C 109.477 no . . .
H76A C76 H76B 109.461 no . . .
H76A C76 H76C 109.481 no . . .
H76B C76 H76C 109.471 no . . .
C75 C77 H77A 109.468 no . . .
C75 C77 H77B 109.468 no . . .
C75 C77 H77C 109.473 no . . .
H77A C77 H77B 109.470 no . . .
H77A C77 H77C 109.471 no . . .
H77B C77 H77C 109.478 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
N1 Pt1 N10 C9 179.1(4) no . . . .
N1 Pt1 N10 C11 -2.5(3) no . . . .
N10 Pt1 N1 C2 -179.5(5) no . . . .
N10 Pt1 N1 C12 3.3(3) no . . . .
N1 Pt1 N51 N52 62.0(4) no . . . .
N1 Pt1 N51 C55 -106.2(4) no . . . .
N51 Pt1 N1 C2 0.9(4) no . . . .
N51 Pt1 N1 C12 -176.4(3) no . . . .
N1 Pt1 C10 C9 179.1(4) no . . . .
N1 Pt1 C10 C11 -2.5(3) no . . . .
C10 Pt1 N1 C2 -179.5(5) no . . . .
C10 Pt1 N1 C12 3.3(3) no . . . .
N10 Pt1 N41 N42 -103.7(3) no . . . .
N10 Pt1 N41 C45 59.6(4) no . . . .
N41 Pt1 N10 C9 -2.7(4) no . . . .
N41 Pt1 N10 C11 175.7(3) no . . . .
N10 Pt1 C1 C2 -179.5(5) no . . . .
N10 Pt1 C1 C12 3.3(3) no . . . .
C1 Pt1 N10 C9 179.1(4) no . . . .
C1 Pt1 N10 C11 -2.5(3) no . . . .
N41 Pt1 N51 N52 -116.2(4) no . . . .
N41 Pt1 N51 C55 75.6(4) no . . . .
N51 Pt1 N41 N42 75.8(3) no . . . .
N51 Pt1 N41 C45 -120.9(4) no . . . .
N41 Pt1 C10 C9 -2.7(4) no . . . .
N41 Pt1 C10 C11 175.7(3) no . . . .
C10 Pt1 N41 N42 -103.7(3) no . . . .
C10 Pt1 N41 C45 59.6(4) no . . . .
N51 Pt1 C1 C2 0.9(4) no . . . .
N51 Pt1 C1 C12 -176.4(3) no . . . .
C1 Pt1 N51 N52 62.0(4) no . . . .
C1 Pt1 N51 C55 -106.2(4) no . . . .
C1 Pt1 C10 C9 179.1(4) no . . . .
C1 Pt1 C10 C11 -2.5(3) no . . . .
C10 Pt1 C1 C2 -179.5(5) no . . . .
C10 Pt1 C1 C12 3.3(3) no . . . .
N30 Pt2 N21 C22 -174.5(5) no . . . .
N30 Pt2 N21 C32 4.7(3) no . . . .
N21 Pt2 N30 C29 178.1(4) no . . . .
N21 Pt2 N30 C31 -5.3(3) no . . . .
N30 Pt2 N61 N62 -93.5(3) no . . . .
N30 Pt2 N61 C65 65.8(4) no . . . .
N61 Pt2 N30 C29 -1.0(4) no . . . .
N61 Pt2 N30 C31 175.6(3) no . . . .
N30 Pt2 C21 C22 -174.5(5) no . . . .
N30 Pt2 C21 C32 4.7(3) no . . . .
C21 Pt2 N30 C29 178.1(4) no . . . .
C21 Pt2 N30 C31 -5.3(3) no . . . .
N21 Pt2 N71 N72 71.0(3) no . . . .
N21 Pt2 N71 C75 -107.1(4) no . . . .
N71 Pt2 N21 C22 9.0(5) no . . . .
N71 Pt2 N21 C32 -171.7(3) no . . . .
N21 Pt2 C30 C29 178.1(4) no . . . .
N21 Pt2 C30 C31 -5.3(3) no . . . .
C30 Pt2 N21 C22 -174.5(5) no . . . .
C30 Pt2 N21 C32 4.7(3) no . . . .
N61 Pt2 N71 N72 -109.6(3) no . . . .
N61 Pt2 N71 C75 72.4(4) no . . . .
N71 Pt2 N61 N62 82.9(3) no . . . .
N71 Pt2 N61 C65 -117.7(4) no . . . .
N61 Pt2 C30 C29 -1.0(4) no . . . .
N61 Pt2 C30 C31 175.6(3) no . . . .
C30 Pt2 N61 N62 -93.5(3) no . . . .
C30 Pt2 N61 C65 65.8(4) no . . . .
N71 Pt2 C21 C22 9.0(5) no . . . .
N71 Pt2 C21 C32 -171.7(3) no . . . .
C21 Pt2 N71 N72 71.0(3) no . . . .
C21 Pt2 N71 C75 -107.1(4) no . . . .
C21 Pt2 C30 C29 178.1(4) no . . . .
C21 Pt2 C30 C31 -5.3(3) no . . . .
C30 Pt2 C21 C22 -174.5(5) no . . . .
C30 Pt2 C21 C32 4.7(3) no . . . .
Pt1 N1 C2 C3 -176.7(3) no . . . .
Pt1 N1 C12 C11 -3.7(6) no . . . .
Pt1 N1 C12 C13 176.8(4) no . . . .
C2 N1 C12 C11 178.6(4) no . . . .
C2 N1 C12 C13 -1.0(7) no . . . .
C12 N1 C2 C3 0.4(7) no . . . .
Pt1 N10 C9 C8 177.8(3) no . . . .
Pt1 N10 C11 C12 1.2(6) no . . . .
Pt1 N10 C11 C14 -177.7(4) no . . . .
C9 N10 C11 C12 179.7(5) no . . . .
C9 N10 C11 C14 0.9(8) no . . . .
C11 N10 C9 C8 -0.5(8) no . . . .
Pt2 N30 C29 C28 175.4(3) no . . . .
Pt2 N30 C31 C32 4.8(6) no . . . .
Pt2 N30 C31 C34 -175.8(3) no . . . .
C29 N30 C31 C32 -178.3(4) no . . . .
C29 N30 C31 C34 1.2(7) no . . . .
C31 N30 C29 C28 -1.1(7) no . . . .
Pt2 N21 C22 C23 -179.9(4) no . . . .
Pt2 N21 C32 C31 -3.6(6) no . . . .
Pt2 N21 C32 C33 177.2(4) no . . . .
C22 N21 C32 C31 175.8(4) no . . . .
C22 N21 C32 C33 -3.4(7) no . . . .
C32 N21 C22 C23 0.9(7) no . . . .
Pt1 N41 N42 Ag1 -32.9(5) no . . . .
Pt1 N41 N42 C43 166.0(3) no . . . .
Pt1 N41 C45 C44 -163.6(3) no . . . .
Pt1 N41 C45 C47 16.0(7) no . . . .
N42 N41 C45 C44 1.1(6) no . . . .
N42 N41 C45 C47 -179.3(4) no . . . .
C45 N41 N42 Ag1 160.4(4) no . . . .
C45 N41 N42 C43 -0.6(5) no . . . .
Ag1 N42 C43 C44 -160.5(3) no . . . .
Ag1 N42 C43 C46 21.6(7) no . . . .
N41 N42 C43 C44 -0.0(6) no . . . .
N41 N42 C43 C46 -178.0(4) no . . . .
Pt1 N51 N52 Ag2 11.6(6) no . . . .
Pt1 N51 N52 C53 -170.5(3) no . . . .
Pt1 N51 C55 C54 169.5(3) no . . . .
Pt1 N51 C55 C57 -9.6(8) no . . . .
N52 N51 C55 C54 0.5(6) no . . . .
N52 N51 C55 C57 -178.6(4) no . . . .
C55 N51 N52 Ag2 -178.0(4) no . . . .
C55 N51 N52 C53 -0.1(6) no . . . .
Ag2 N52 C53 C54 177.4(3) no . . . .
Ag2 N52 C53 C56 -4.4(8) no . . . .
N51 N52 C53 C54 -0.3(6) no . . . .
N51 N52 C53 C56 178.0(4) no . . . .
Pt2 N61 N62 Ag2 -35.9(5) no . . . .
Pt2 N61 N62 C63 164.2(3) no . . . .
Pt2 N61 C65 C64 -161.4(3) no . . . .
Pt2 N61 C65 C67 16.8(7) no . . . .
N62 N61 C65 C64 -0.2(6) no . . . .
N62 N61 C65 C67 178.1(4) no . . . .
C65 N61 N62 Ag2 160.9(4) no . . . .
C65 N61 N62 C63 1.0(5) no . . . .
Ag2 N62 C63 C64 -159.9(3) no . . . .
Ag2 N62 C63 C66 20.4(7) no . . . .
N61 N62 C63 C64 -1.4(6) no . . . .
N61 N62 C63 C66 178.9(4) no . . . .
Pt2 N71 N72 Ag1 1.5(5) no . . . .
Pt2 N71 N72 C73 -179.4(3) no . . . .
Pt2 N71 C75 C74 178.6(3) no . . . .
Pt2 N71 C75 C77 -0.6(8) no . . . .
N72 N71 C75 C74 0.4(6) no . . . .
N72 N71 C75 C77 -178.8(4) no . . . .
C75 N71 N72 Ag1 179.9(4) no . . . .
C75 N71 N72 C73 -0.9(5) no . . . .
Ag1 N72 C73 C74 -179.9(3) no . . . .
Ag1 N72 C73 C76 -1.4(8) no . . . .
N71 N72 C73 C74 1.1(6) no . . . .
N71 N72 C73 C76 179.6(4) no . . . .
Pt1 C1 C2 C3 -176.7(3) no . . . .
Pt1 C1 C12 C11 -3.7(6) no . . . .
Pt1 C1 C12 C13 176.8(4) no . . . .
C2 C1 C12 C11 178.6(4) no . . . .
C2 C1 C12 C13 -1.0(7) no . . . .
C12 C1 C2 C3 0.4(7) no . . . .
N1 C2 C3 C4 0.9(8) no . . . .
C1 C2 C3 C4 0.9(8) no . . . .
C2 C3 C4 C13 -1.7(8) no . . . .
C3 C4 C13 C5 -179.0(5) no . . . .
C3 C4 C13 C12 1.2(8) no . . . .
C6 C5 C13 C4 178.9(5) no . . . .
C6 C5 C13 C12 -1.3(8) no . . . .
C13 C5 C6 C14 0.8(9) no . . . .
C5 C6 C14 C7 178.5(5) no . . . .
C5 C6 C14 C11 0.2(8) no . . . .
C8 C7 C14 C6 -179.1(5) no . . . .
C8 C7 C14 C11 -0.7(8) no . . . .
C14 C7 C8 C9 1.1(8) no . . . .
C7 C8 C9 N10 -0.5(8) no . . . .
C7 C8 C9 C10 -0.5(8) no . . . .
C8 C9 C10 Pt1 177.8(4) no . . . .
C8 C9 C10 C11 -0.5(8) no . . . .
Pt1 C10 C11 C12 1.2(6) no . . . .
Pt1 C10 C11 C14 -177.7(4) no . . . .
C9 C10 C11 C12 179.7(5) no . . . .
C9 C10 C11 C14 0.9(8) no . . . .
N10 C11 C12 N1 1.6(7) no . . . .
N10 C11 C12 C1 1.6(7) no . . . .
N10 C11 C12 C13 -178.8(4) no . . . .
N10 C11 C14 C6 178.2(5) no . . . .
N10 C11 C14 C7 -0.3(8) no . . . .
C10 C11 C12 N1 1.6(7) no . . . .
C10 C11 C12 C1 1.6(7) no . . . .
C10 C11 C12 C13 -178.8(4) no . . . .
C10 C11 C14 C6 178.2(5) no . . . .
C10 C11 C14 C7 -0.3(8) no . . . .
C12 C11 C14 C6 -0.6(8) no . . . .
C12 C11 C14 C7 -179.1(5) no . . . .
C14 C11 C12 N1 -179.5(5) no . . . .
C14 C11 C12 C1 -179.5(5) no . . . .
C14 C11 C12 C13 0.1(8) no . . . .
N1 C12 C13 C4 0.2(8) no . . . .
N1 C12 C13 C5 -179.6(5) no . . . .
C1 C12 C13 C4 0.2(8) no . . . .
C1 C12 C13 C5 -179.6(5) no . . . .
C11 C12 C13 C4 -179.4(5) no . . . .
C11 C12 C13 C5 0.8(8) no . . . .
Pt2 C21 C22 C23 -179.9(4) no . . . .
Pt2 C21 C32 C31 -3.6(6) no . . . .
Pt2 C21 C32 C33 177.2(4) no . . . .
C22 C21 C32 C31 175.8(4) no . . . .
C22 C21 C32 C33 -3.4(7) no . . . .
C32 C21 C22 C23 0.9(7) no . . . .
N21 C22 C23 C24 0.9(8) no . . . .
C21 C22 C23 C24 0.9(8) no . . . .
C22 C23 C24 C33 -0.4(8) no . . . .
C23 C24 C33 C25 180.0(5) no . . . .
C23 C24 C33 C32 -1.9(8) no . . . .
C26 C25 C33 C24 176.0(5) no . . . .
C26 C25 C33 C32 -2.1(8) no . . . .
C33 C25 C26 C34 -0.8(8) no . . . .
C25 C26 C34 C27 -178.3(5) no . . . .
C25 C26 C34 C31 2.6(8) no . . . .
C28 C27 C34 C26 -179.9(5) no . . . .
C28 C27 C34 C31 -0.8(8) no . . . .
C34 C27 C28 C29 0.9(8) no . . . .
C27 C28 C29 N30 0.0(8) no . . . .
C27 C28 C29 C30 0.0(8) no . . . .
C28 C29 C30 Pt2 175.4(4) no . . . .
C28 C29 C30 C31 -1.1(8) no . . . .
Pt2 C30 C31 C32 4.8(6) no . . . .
Pt2 C30 C31 C34 -175.8(3) no . . . .
C29 C30 C31 C32 -178.3(4) no . . . .
C29 C30 C31 C34 1.2(7) no . . . .
N30 C31 C32 N21 -0.8(7) no . . . .
N30 C31 C32 C21 -0.8(7) no . . . .
N30 C31 C32 C33 178.4(4) no . . . .
N30 C31 C34 C26 178.9(5) no . . . .
N30 C31 C34 C27 -0.3(8) no . . . .
C30 C31 C32 N21 -0.8(7) no . . . .
C30 C31 C32 C21 -0.8(7) no . . . .
C30 C31 C32 C33 178.4(4) no . . . .
C30 C31 C34 C26 178.9(5) no . . . .
C30 C31 C34 C27 -0.3(8) no . . . .
C32 C31 C34 C26 -1.7(8) no . . . .
C32 C31 C34 C27 179.2(5) no . . . .
C34 C31 C32 N21 179.7(5) no . . . .
C34 C31 C32 C21 179.7(5) no . . . .
C34 C31 C32 C33 -1.1(8) no . . . .
N21 C32 C33 C24 3.9(8) no . . . .
N21 C32 C33 C25 -177.9(5) no . . . .
C21 C32 C33 C24 3.9(8) no . . . .
C21 C32 C33 C25 -177.9(5) no . . . .
C31 C32 C33 C24 -175.2(5) no . . . .
C31 C32 C33 C25 3.0(7) no . . . .
N42 C43 C44 C45 0.6(6) no . . . .
C46 C43 C44 C45 178.4(5) no . . . .
C43 C44 C45 N41 -1.0(6) no . . . .
C43 C44 C45 C47 179.4(5) no . . . .
N52 C53 C54 C55 0.6(6) no . . . .
C56 C53 C54 C55 -177.4(6) no . . . .
C53 C54 C55 N51 -0.6(6) no . . . .
C53 C54 C55 C57 178.3(5) no . . . .
N62 C63 C64 C65 1.3(6) no . . . .
C66 C63 C64 C65 -179.1(5) no . . . .
C63 C64 C65 N61 -0.6(6) no . . . .
C63 C64 C65 C67 -178.7(5) no . . . .
N72 C73 C74 C75 -0.8(6) no . . . .
C76 C73 C74 C75 -179.2(5) no . . . .
C73 C74 C75 N71 0.3(6) no . . . .
C73 C74 C75 C77 179.3(5) no . . . .

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
Pt1 Ag2 3.4574(5) no . .
Pt1 C47 3.528(6) no . .
Pt1 C57 3.426(6) no . .
Pt2 Ag1 3.3546(6) no . .
Pt2 C67 3.491(6) no . .
Pt2 C77 3.494(7) no . .
Ag1 Ag2 3.1023(6) no . .
Ag1 N21 3.438(6) no . .
Ag1 N51 3.355(5) no . .
Ag1 N52 3.220(5) no . .
Ag1 C21 3.438(6) no . .
Ag1 C46 3.421(6) no . .
Ag1 C76 3.559(6) no . .
Ag2 N1 3.445(5) no . .
Ag2 N71 3.510(5) no . .
Ag2 N72 3.279(5) no . .
Ag2 C1 3.445(5) no . .
Ag2 C2 3.480(6) no . .
Ag2 C56 3.459(6) no . .
Ag2 C66 3.411(6) no . .
N1 N52 3.292(7) no . .
N1 C4 2.863(8) no . .
N10 C7 2.800(8) no . .
N10 C45 3.551(7) no . .
N30 C27 2.791(7) no . .
N30 C65 3.544(7) no . .
N21 N72 3.386(7) no . .
N21 C24 2.852(8) no . .
N41 C9 3.188(7) no . .
N42 N51 3.504(7) no . .
N51 C2 3.172(8) no . .
N52 C1 3.292(7) no . .
N52 C2 3.181(8) no . .
N61 C29 3.114(7) no . .
N71 C22 3.208(7) no . .
N72 C21 3.386(7) no . .
N72 C22 3.423(7) no . .
C1 C4 2.863(8) no . .
C2 C13 2.805(8) no . .
C3 C12 2.745(8) no . .
C5 C11 2.785(9) no . .
C6 C12 2.801(8) no . .
C7 C10 2.800(8) no . .
C8 C11 2.723(8) no . .
C9 C12 3.587(8) no . .
C9 C14 2.765(8) no . .
C9 C45 3.317(8) no . .
C9 C47 3.440(8) no . .
C10 C45 3.551(7) no . .
C13 C14 2.856(8) no . .
C21 C24 2.852(8) no . .
C22 C33 2.811(8) no . .
C23 C32 2.735(8) no . .
C25 C31 2.798(8) no . .
C26 C32 2.817(8) no . .
C27 C30 2.791(7) no . .
C28 C31 2.744(8) no . .
C29 C32 3.597(8) no . .
C29 C34 2.770(8) no . .
C29 C65 3.305(8) no . .
C29 C67 3.583(8) no . .
C30 C65 3.544(7) no . .
C33 C34 2.854(8) no . .
C53 C76 3.545(9) no . .
C56 C76 3.526(9) no . .
N10 C27 3.227(7) no . 3_666
N10 C34 3.363(7) no . 3_666
N30 C8 3.474(8) no . 3_666
N30 C27 3.267(7) no . 3_666
N42 C27 3.530(8) no . 3_666
N42 C28 3.505(7) no . 3_666
N62 C26 3.591(7) no . 3_666
N62 C56 3.491(7) no . 3_656
C2 C7 3.598(8) no . 2_545
C2 C8 3.592(8) no . 2_545
C3 C8 3.451(8) no . 2_545
C4 C23 3.546(8) no . 4_554
C4 C67 3.586(8) no . 4_454
C5 C25 3.493(8) no . 3_666
C6 C25 3.364(8) no . 3_666
C6 C33 3.452(8) no . 3_666
C7 C2 3.598(8) no . 2_555
C7 C31 3.396(8) no . 3_666
C7 C32 3.517(8) no . 3_666
C8 N30 3.474(8) no . 3_666
C8 C2 3.592(8) no . 2_555
C8 C3 3.451(8) no . 2_555
C8 C30 3.474(8) no . 3_666
C8 C31 3.438(8) no . 3_666
C9 C27 3.197(8) no . 3_666
C9 C28 3.331(8) no . 3_666
C9 C34 3.442(8) no . 3_666
C10 C27 3.227(7) no . 3_666
C10 C34 3.363(7) no . 3_666
C11 C26 3.232(8) no . 3_666
C11 C34 3.418(8) no . 3_666
C11 C77 3.428(9) no . 4_454
C12 C26 3.446(8) no . 3_666
C13 C67 3.524(8) no . 4_454
C14 C25 3.469(8) no . 3_666
C14 C26 3.466(8) no . 3_666
C14 C34 3.591(8) no . 3_666
C14 C77 3.579(9) no . 4_454
C23 C4 3.546(8) no . 4_455
C25 C5 3.493(8) no . 3_666
C25 C6 3.364(8) no . 3_666
C25 C14 3.469(8) no . 3_666
C26 N62 3.591(7) no . 3_666
C26 C11 3.232(8) no . 3_666
C26 C12 3.446(8) no . 3_666
C26 C14 3.466(8) no . 3_666
C26 C29 3.451(8) no . 3_666
C27 N10 3.227(7) no . 3_666
C27 N30 3.267(7) no . 3_666
C27 N42 3.530(8) no . 3_666
C27 C9 3.197(8) no . 3_666
C27 C10 3.227(7) no . 3_666
C27 C29 3.447(8) no . 3_666
C27 C30 3.267(7) no . 3_666
C27 C31 3.395(8) no . 3_666
C28 N42 3.505(7) no . 3_666
C28 C9 3.331(8) no . 3_666
C28 C31 3.293(8) no . 3_666
C28 C34 3.312(8) no . 3_666
C29 C26 3.451(8) no . 3_666
C29 C27 3.447(8) no . 3_666
C29 C34 3.286(8) no . 3_666
C30 C8 3.474(8) no . 3_666
C30 C27 3.267(7) no . 3_666
C31 C7 3.396(8) no . 3_666
C31 C8 3.438(8) no . 3_666
C31 C27 3.395(8) no . 3_666
C31 C28 3.293(8) no . 3_666
C32 C7 3.517(8) no . 3_666
C33 C6 3.452(8) no . 3_666
C34 N10 3.363(7) no . 3_666
C34 C9 3.442(8) no . 3_666
C34 C10 3.363(7) no . 3_666
C34 C11 3.418(8) no . 3_666
C34 C14 3.591(8) no . 3_666
C34 C28 3.312(8) no . 3_666
C34 C29 3.286(8) no . 3_666
C44 C44 3.585(8) no . 3_566
C56 N62 3.491(7) no . 3_656
C56 C63 3.576(8) no . 3_656
C63 C56 3.576(8) no . 3_656
C67 C4 3.586(8) no . 4_555
C67 C13 3.524(8) no . 4_555
C77 C11 3.428(9) no . 4_555
C77 C14 3.579(9) no . 4_555
Pt1 H2 3.2565 no . .
Pt1 H9 3.1688 no . .
Pt1 H47B 2.9481 no . .
Pt1 H57A 3.4888 no . .
Pt1 H57B 3.1250 no . .
Pt2 H22 3.2789 no . .
Pt2 H29 3.1571 no . .
Pt2 H67A 2.9792 no . .
Pt2 H77A 3.2151 no . .
Pt2 H77B 3.5510 no . .
Ag1 H46B 2.8179 no . .
Ag1 H76B 2.9883 no . .
Ag2 H2 3.3025 no . .
Ag2 H56A 3.1670 no . .
Ag2 H56B 3.4843 no . .
Ag2 H66A 2.9947 no . .
Ag2 H66B 3.5977 no . .
N1 H3 3.2905 no . .
N1 H66A 3.4533 no . .
N10 H8 3.2399 no . .
N10 H47B 3.1501 no . .
N30 H28 3.2436 no . .
N30 H67A 3.5053 no . .
N30 H67B 3.5721 no . .
N21 H23 3.2856 no . .
N21 H46B 3.3026 no . .
N41 H9 2.6597 no . .
N41 H44 3.1394 no . .
N41 H47A 3.0831 no . .
N41 H47B 2.5502 no . .
N41 H47C 3.1298 no . .
N41 H57B 2.8505 no . .
N42 H9 3.3399 no . .
N42 H44 3.1480 no . .
N42 H46A 3.0609 no . .
N42 H46B 2.5367 no . .
N42 H46C 3.1379 no . .
N51 H2 2.7138 no . .
N51 H54 3.1261 no . .
N51 H57A 2.8366 no . .
N51 H57B 2.6170 no . .
N51 H57C 3.2324 no . .
N52 H2 2.5762 no . .
N52 H54 3.1375 no . .
N52 H56A 2.6510 no . .
N52 H56B 2.7700 no . .
N52 H56C 3.2430 no . .
N61 H29 2.5781 no . .
N61 H64 3.1464 no . .
N61 H67A 2.5401 no . .
N61 H67B 3.0097 no . .
N61 H67C 3.1582 no . .
N61 H77B 3.2333 no . .
N62 H29 3.0809 no . .
N62 H64 3.1475 no . .
N62 H66A 2.5610 no . .
N62 H66B 2.9439 no . .
N62 H66C 3.2020 no . .
N71 H22 2.7780 no . .
N71 H74 3.1434 no . .
N71 H77A 2.6576 no . .
N71 H77B 2.8101 no . .
N71 H77C 3.2558 no . .
N72 H22 2.9094 no . .
N72 H56A 3.3064 no . .
N72 H74 3.1399 no . .
N72 H76A 3.0437 no . .
N72 H76B 2.5330 no . .
N72 H76C 3.1362 no . .
C1 H3 3.2905 no . .
C1 H66A 3.4533 no . .
C2 H4 3.2871 no . .
C2 H66A 3.1415 no . .
C3 H66A 2.9959 no . .
C4 H2 3.2775 no . .
C4 H5 2.6926 no . .
C4 H66A 3.1552 no . .
C5 H4 2.7011 no . .
C6 H7 2.7205 no . .
C7 H6 2.7152 no . .
C7 H9 3.2501 no . .
C9 H7 3.2620 no . .
C9 H47B 3.2205 no . .
C9 H47C 3.2412 no . .
C10 H8 3.2399 no . .
C10 H47B 3.1501 no . .
C11 H6 3.2815 no . .
C11 H7 3.2605 no . .
C11 H9 3.1801 no . .
C12 H2 3.2519 no . .
C12 H4 3.2756 no . .
C12 H5 3.2872 no . .
C12 H66A 3.5679 no . .
C13 H3 3.2518 no . .
C13 H6 3.2841 no . .
C13 H66A 3.4566 no . .
C14 H5 3.2722 no . .
C14 H8 3.2625 no . .
C21 H23 3.2856 no . .
C21 H46B 3.3026 no . .
C22 H24 3.2719 no . .
C22 H46B 3.0221 no . .
C23 H46B 3.0044 no . .
C24 H22 3.2618 no . .
C24 H25 2.7117 no . .
C24 H46A 3.4742 no . .
C24 H46B 3.2440 no . .
C25 H24 2.7046 no . .
C26 H27 2.7222 no . .
C27 H26 2.7158 no . .
C27 H29 3.2539 no . .
C29 H27 3.2635 no . .
C29 H67B 3.1697 no . .
C30 H28 3.2436 no . .
C30 H67A 3.5053 no . .
C30 H67B 3.5721 no . .
C31 H26 3.2900 no . .
C31 H27 3.2794 no . .
C31 H29 3.1911 no . .
C32 H22 3.2518 no . .
C32 H24 3.2649 no . .
C32 H25 3.3045 no . .
C32 H46B 3.5134 no . .
C33 H23 3.2523 no . .
C33 H26 3.2934 no . .
C33 H46A 3.5534 no . .
C33 H46B 3.4907 no . .
C34 H25 3.2926 no . .
C34 H28 3.2658 no . .
C44 H9 3.2014 no . .
C44 H46A 2.9154 no . .
C44 H46B 3.3621 no . .
C44 H46C 2.8647 no . .
C44 H47A 2.9230 no . .
C44 H47B 3.3710 no . .
C44 H47C 2.8708 no . .
C45 H9 2.5560 no . .
C45 H57B 3.0320 no . .
C46 H44 2.9466 no . .
C47 H9 2.8597 no . .
C47 H44 2.9499 no . .
C47 H57B 2.9345 no . .
C53 H2 3.1151 no . .
C53 H76A 2.9653 no . .
C53 H76B 3.4168 no . .
C54 H2 3.5374 no . .
C54 H56A 3.2616 no . .
C54 H56B 3.1511 no . .
C54 H56C 2.7277 no . .
C54 H57A 3.1399 no . .
C54 H57B 3.3198 no . .
C54 H57C 2.7769 no . .
C54 H76A 3.4155 no . .
C55 H2 3.3000 no . .
C56 H54 2.9492 no . .
C56 H76A 2.7661 no . .
C57 H47B 3.3762 no . .
C57 H54 2.9867 no . .
C63 H29 3.3449 no . .
C64 H29 3.0587 no . .
C64 H66A 3.3443 no . .
C64 H66B 3.0447 no . .
C64 H66C 2.7921 no . .
C64 H67A 3.3423 no . .
C64 H67B 2.9350 no . .
C64 H67C 2.8060 no . .
C65 H29 2.5487 no . .
C65 H77B 3.3429 no . .
C66 H64 2.9644 no . .
C67 H29 3.0187 no . .
C67 H64 2.9263 no . .
C67 H77A 3.5926 no . .
C67 H77B 3.1907 no . .
C73 H22 3.5003 no . .
C73 H56A 2.8729 no . .
C74 H56A 3.3035 no . .
C74 H76A 2.9354 no . .
C74 H76B 3.3493 no . .
C74 H76C 2.8241 no . .
C74 H77A 3.2728 no . .
C74 H77B 3.1633 no . .
C74 H77C 2.7357 no . .
C75 H22 3.3174 no . .
C76 H56A 3.0208 no . .
C76 H56C 3.5337 no . .
C76 H74 2.9263 no . .
C77 H67A 3.1075 no . .
C77 H74 2.9604 no . .
H2 H3 2.3278 no . .
H2 H56B 3.5322 no . .
H2 H66A 3.5621 no . .
H3 H4 2.3265 no . .
H3 H66A 3.3586 no . .
H4 H5 2.5538 no . .
H4 H66A 3.5765 no . .
H5 H6 2.2711 no . .
H6 H7 2.5843 no . .
H7 H8 2.3323 no . .
H8 H9 2.3301 no . .
H9 H47B 2.8942 no . .
H9 H47C 2.6388 no . .
H22 H23 2.3300 no . .
H22 H46B 3.4041 no . .
H23 H24 2.2979 no . .
H23 H46B 3.3890 no . .
H24 H25 2.5662 no . .
H25 H26 2.2983 no . .
H26 H27 2.5846 no . .
H27 H28 2.3305 no . .
H28 H29 2.3392 no . .
H29 H67A 3.3373 no . .
H29 H67B 2.6572 no . .
H44 H46A 3.0878 no . .
H44 H46C 2.9865 no . .
H44 H47A 3.0875 no . .
H44 H47C 2.9909 no . .
H47A H57B 2.7753 no . .
H47B H57A 3.2913 no . .
H47B H57B 2.6221 no . .
H54 H56B 3.5021 no . .
H54 H56C 2.7392 no . .
H54 H57A 3.4645 no . .
H54 H57C 2.8098 no . .
H54 H76A 3.5421 no . .
H56A H76A 2.4090 no . .
H56A H76B 3.4326 no . .
H56C H76A 2.6184 no . .
H64 H66B 3.3062 no . .
H64 H66C 2.8518 no . .
H64 H67B 3.1345 no . .
H64 H67C 2.8981 no . .
H67A H77A 2.7110 no . .
H67A H77B 2.6484 no . .
H67C H77B 3.2022 no . .
H74 H76A 3.1129 no . .
H74 H76C 2.9206 no . .
H74 H77B 3.5040 no . .
H74 H77C 2.7509 no . .
Pt1 H27 3.2764 no . 3_666
Pt2 H27 3.5031 no . 3_666
Ag1 H27 3.0414 no . 3_666
Ag2 H26 3.2727 no . 3_666
Ag2 H27 3.4014 no . 3_666
N1 H26 3.5016 no . 3_666
N10 H27 3.2169 no . 3_666
N10 H77A 3.2873 no . 4_454
N10 H77C 3.0748 no . 4_454
N30 H8 3.4006 no . 3_666
N30 H27 3.2071 no . 3_666
N41 H27 3.3969 no . 3_666
N41 H64 3.3618 no . 1_455
N42 H27 2.9840 no . 3_666
N42 H28 2.9286 no . 3_666
N61 H56B 3.4499 no . 3_656
N61 H56C 2.8975 no . 3_656
N62 H26 2.7724 no . 3_666
N62 H56B 3.5123 no . 3_656
N62 H56C 2.8001 no . 3_656
N71 H56B 3.3199 no . 3_656
C1 H26 3.5016 no . 3_666
C2 H7 3.2052 no . 2_545
C2 H8 3.1825 no . 2_545
C3 H8 2.8715 no . 2_545
C3 H23 3.1817 no . 4_554
C3 H46C 3.4504 no . 4_554
C3 H74 3.2147 no . 3_656
C4 H8 3.5024 no . 2_545
C4 H23 2.9193 no . 4_554
C4 H46B 3.4702 no . 4_554
C4 H46C 3.0572 no . 4_554
C4 H67A 3.4983 no . 4_454
C4 H67B 3.4218 no . 4_454
C4 H67C 3.2489 no . 4_454
C5 H25 3.2529 no . 3_666
C5 H67C 2.8867 no . 4_454
C5 H76B 3.4464 no . 4_554
C5 H76C 3.1407 no . 4_554
C6 H25 3.4703 no . 3_666
C6 H54 3.2569 no . 2_555
C6 H57A 3.4701 no . 2_555
C6 H67C 3.5626 no . 4_454
C6 H76C 3.1450 no . 4_554
C7 H2 3.2136 no . 2_555
C7 H57A 3.4899 no . 2_555
C7 H77C 3.1203 no . 4_454
C8 H2 3.4598 no . 2_555
C8 H3 3.2016 no . 2_555
C8 H67B 3.5809 no . 3_666
C8 H77C 3.0777 no . 4_454
C9 H27 3.4727 no . 3_666
C9 H77C 3.0526 no . 4_454
C10 H27 3.2169 no . 3_666
C10 H77A 3.2873 no . 4_454
C10 H77C 3.0748 no . 4_454
C11 H26 3.3199 no . 3_666
C11 H77A 3.1614 no . 4_454
C11 H77B 3.5062 no . 4_454
C11 H77C 3.0644 no . 4_454
C12 H26 3.2009 no . 3_666
C12 H67A 3.5620 no . 4_454
C12 H77A 3.4104 no . 4_454
C13 H25 3.4695 no . 3_666
C13 H67A 3.2925 no . 4_454
C13 H67C 3.0174 no . 4_454
C14 H77B 3.3884 no . 4_454
C14 H77C 3.1160 no . 4_454
C22 H4 3.3161 no . 4_455
C22 H57A 3.4754 no . 4_555
C23 H3 3.5540 no . 4_455
C23 H4 2.8854 no . 4_455
C23 H57A 3.3931 no . 4_555
C23 H66B 3.5541 no . 4_455
C23 H66C 3.3271 no . 4_455
C24 H6 3.4084 no . 3_666
C24 H47C 3.5143 no . 3_566
C24 H74 3.5946 no . 2_556
C24 H76C 3.4158 no . 2_556
C25 H47A 3.2667 no . 3_566
C26 H29 3.2878 no . 3_666
C26 H66A 3.3624 no . 3_666
C27 H9 3.2972 no . 3_666
C28 H9 3.1337 no . 3_666
C28 H44 3.2729 no . 1_655
C29 H8 3.4631 no . 3_666
C29 H26 3.5585 no . 3_666
C29 H27 3.5809 no . 3_666
C29 H44 3.3471 no . 1_655
C30 H8 3.4006 no . 3_666
C30 H27 3.2071 no . 3_666
C31 H27 3.5222 no . 3_666
C31 H28 3.3678 no . 3_666
C32 H7 3.4586 no . 3_666
C32 H28 3.4113 no . 3_666
C33 H6 3.4499 no . 3_666
C34 H28 3.5639 no . 3_666
C34 H29 3.5211 no . 3_666
C43 H28 2.9426 no . 3_666
C43 H44 3.2068 no . 3_566
C43 H67B 3.2349 no . 1_455
C44 H29 3.4768 no . 1_455
C44 H44 3.1980 no . 3_566
C44 H46A 2.8934 no . 3_566
C44 H64 3.2466 no . 1_455
C44 H67B 3.3245 no . 1_455
C45 H46A 3.2883 no . 3_566
C45 H64 3.0610 no . 1_455
C46 H4 2.9842 no . 4_455
C46 H28 3.0843 no . 3_666
C46 H44 3.1471 no . 3_566
C46 H47C 3.4198 no . 3_566
C46 H67B 3.1057 no . 1_455
C47 H25 3.3167 no . 3_566
C47 H46A 3.2868 no . 3_566
C47 H64 3.5093 no . 1_455
C47 H66C 3.4159 no . 1_455
C53 H77B 3.4677 no . 3_656
C54 H6 3.1025 no . 2_545
C55 H6 3.1568 no . 2_545
C55 H7 3.4357 no . 2_545
C56 H56A 3.3197 no . 3_656
C56 H56B 3.5912 no . 3_656
C56 H77B 3.1790 no . 3_656
C57 H6 2.9307 no . 2_545
C57 H7 3.4181 no . 2_545
C57 H64 3.1675 no . 1_455
C57 H66C 3.2284 no . 1_455
C57 H76C 3.3903 no . 3_556
C63 H26 3.0441 no . 3_666
C63 H47A 3.4605 no . 1_655
C63 H56C 2.7175 no . 3_656
C64 H47A 3.3452 no . 1_655
C64 H56C 2.8077 no . 3_656
C64 H57B 3.2647 no . 1_655
C65 H56C 2.8979 no . 3_656
C66 H23 2.9351 no . 4_554
C66 H25 3.4979 no . 3_666
C66 H26 3.1434 no . 3_666
C66 H47A 3.3240 no . 1_655
C66 H56C 3.5080 no . 3_656
C66 H57B 3.4672 no . 1_655
C66 H57C 3.3420 no . 1_655
C66 H74 3.5980 no . 3_656
C66 H76A 3.4354 no . 3_656
C67 H8 3.3060 no . 3_666
C67 H46C 3.1315 no . 1_655
C73 H5 3.5257 no . 4_455
C73 H66B 3.5367 no . 3_656
C74 H3 3.4007 no . 3_656
C74 H24 3.2638 no . 2_546
C74 H56B 3.1567 no . 3_656
C74 H66B 3.3342 no . 3_656
C75 H56B 2.8739 no . 3_656
C76 H5 2.9402 no . 4_455
C76 H6 3.3672 no . 4_455
C76 H57C 2.9831 no . 3_556
C76 H66B 3.1579 no . 3_656
C77 H56B 3.1607 no . 3_656
H2 C7 3.2136 no . 2_545
H2 C8 3.4598 no . 2_545
H2 H7 2.8683 no . 2_545
H2 H8 3.3042 no . 2_545
H2 H74 3.3889 no . 3_656
H2 H77C 3.2231 no . 3_656
H3 C8 3.2016 no . 2_545
H3 C23 3.5540 no . 4_554
H3 C74 3.4007 no . 3_656
H3 H8 2.7801 no . 2_545
H3 H23 2.9628 no . 4_554
H3 H24 3.3852 no . 4_554
H3 H46C 3.2281 no . 4_554
H3 H74 2.5321 no . 3_656
H3 H77C 3.1475 no . 3_656
H4 C22 3.3161 no . 4_554
H4 C23 2.8854 no . 4_554
H4 C46 2.9842 no . 4_554
H4 H22 3.2277 no . 4_554
H4 H23 2.4579 no . 4_554
H4 H46A 3.5803 no . 4_554
H4 H46B 2.5947 no . 4_554
H4 H46C 2.5055 no . 4_554
H4 H67B 3.3776 no . 4_454
H4 H67C 3.2465 no . 4_454
H5 C73 3.5257 no . 4_554
H5 C76 2.9402 no . 4_554
H5 H25 3.4850 no . 3_666
H5 H67C 2.8729 no . 4_454
H5 H76B 2.6164 no . 4_554
H5 H76C 2.5204 no . 4_554
H6 C24 3.4084 no . 3_666
H6 C33 3.4499 no . 3_666
H6 C54 3.1025 no . 2_555
H6 C55 3.1568 no . 2_555
H6 C57 2.9307 no . 2_555
H6 C76 3.3672 no . 4_554
H6 H24 3.4737 no . 3_666
H6 H54 2.7775 no . 2_555
H6 H57A 2.6213 no . 2_555
H6 H57C 2.6864 no . 2_555
H6 H76B 3.3947 no . 4_554
H6 H76C 2.5385 no . 4_554
H7 C2 3.2052 no . 2_555
H7 C32 3.4586 no . 3_666
H7 C55 3.4357 no . 2_555
H7 C57 3.4181 no . 2_555
H7 H2 2.8683 no . 2_555
H7 H57A 2.6509 no . 2_555
H8 N30 3.4006 no . 3_666
H8 C2 3.1825 no . 2_555
H8 C3 2.8715 no . 2_555
H8 C4 3.5024 no . 2_555
H8 C29 3.4631 no . 3_666
H8 C30 3.4006 no . 3_666
H8 C67 3.3060 no . 3_666
H8 H2 3.3043 no . 2_555
H8 H3 2.7801 no . 2_555
H8 H46C 3.1495 no . 3_566
H8 H67A 2.9919 no . 3_666
H8 H67B 2.7255 no . 3_666
H8 H77C 3.5952 no . 4_454
H9 C27 3.2972 no . 3_666
H9 C28 3.1337 no . 3_666
H9 H27 3.5106 no . 3_666
H9 H28 3.2346 no . 3_666
H9 H46A 3.4190 no . 3_566
H9 H46C 3.3032 no . 3_566
H9 H77C 3.5647 no . 4_454
H22 H4 3.2277 no . 4_455
H23 C3 3.1817 no . 4_455
H23 C4 2.9193 no . 4_455
H23 C66 2.9351 no . 4_455
H23 H3 2.9628 no . 4_455
H23 H4 2.4579 no . 4_455
H23 H57A 3.5467 no . 4_555
H23 H66A 2.9986 no . 4_455
H23 H66B 2.7548 no . 4_455
H23 H66C 2.5665 no . 4_455
H23 H74 3.3819 no . 2_556
H24 C74 3.2637 no . 2_556
H24 H3 3.3852 no . 4_455
H24 H6 3.4737 no . 3_666
H24 H47C 3.0528 no . 3_566
H24 H74 2.7900 no . 2_556
H24 H76C 2.8988 no . 2_556
H25 C5 3.2529 no . 3_666
H25 C6 3.4703 no . 3_666
H25 C13 3.4695 no . 3_666
H25 C47 3.3167 no . 3_566
H25 C66 3.4979 no . 3_666
H25 H5 3.4850 no . 3_666
H25 H47A 2.6074 no . 3_566
H25 H47C 3.1655 no . 3_566
H25 H66A 3.1680 no . 3_666
H25 H66C 3.0977 no . 3_666
H26 Ag2 3.2727 no . 3_666
H26 N1 3.5016 no . 3_666
H26 N62 2.7724 no . 3_666
H26 C1 3.5016 no . 3_666
H26 C11 3.3199 no . 3_666
H26 C12 3.2009 no . 3_666
H26 C29 3.5585 no . 3_666
H26 C63 3.0441 no . 3_666
H26 C66 3.1434 no . 3_666
H26 H29 3.2492 no . 3_666
H26 H66A 2.5658 no . 3_666
H26 H66C 3.4129 no . 3_666
H27 Pt1 3.2764 no . 3_666
H27 Pt2 3.5031 no . 3_666
H27 Ag1 3.0414 no . 3_666
H27 Ag2 3.4014 no . 3_666
H27 N10 3.2169 no . 3_666
H27 N30 3.2071 no . 3_666
H27 N41 3.3969 no . 3_666
H27 N42 2.9840 no . 3_666
H27 C9 3.4727 no . 3_666
H27 C10 3.2169 no . 3_666
H27 C29 3.5809 no . 3_666
H27 C30 3.2071 no . 3_666
H27 C31 3.5222 no . 3_666
H27 H9 3.5106 no . 3_666
H28 N42 2.9286 no . 3_666
H28 C31 3.3678 no . 3_666
H28 C32 3.4113 no . 3_666
H28 C34 3.5639 no . 3_666
H28 C43 2.9426 no . 3_666
H28 C46 3.0843 no . 3_666
H28 H9 3.2346 no . 3_666
H28 H44 2.6737 no . 1_655
H28 H46A 2.7107 no . 3_666
H28 H46B 3.1251 no . 3_666
H29 C26 3.2878 no . 3_666
H29 C34 3.5211 no . 3_666
H29 C44 3.4768 no . 1_655
H29 H26 3.2492 no . 3_666
H29 H44 2.8104 no . 1_655
H44 C28 3.2729 no . 1_455
H44 C29 3.3471 no . 1_455
H44 C43 3.2068 no . 3_566
H44 C44 3.1980 no . 3_566
H44 C46 3.1471 no . 3_566
H44 H28 2.6737 no . 1_455
H44 H29 2.8104 no . 1_455
H44 H44 3.0676 no . 3_566
H44 H46A 2.3700 no . 3_566
H44 H64 3.5877 no . 1_455
H44 H67B 3.2059 no . 1_455
H46A C44 2.8934 no . 3_566
H46A C45 3.2883 no . 3_566
H46A C47 3.2868 no . 3_566
H46A H4 3.5803 no . 4_455
H46A H9 3.4190 no . 3_566
H46A H28 2.7107 no . 3_666
H46A H44 2.3700 no . 3_566
H46A H47C 2.5942 no . 3_566
H46B C4 3.4702 no . 4_455
H46B H4 2.5947 no . 4_455
H46B H28 3.1251 no . 3_666
H46C C3 3.4504 no . 4_455
H46C C4 3.0572 no . 4_455
H46C C67 3.1315 no . 1_455
H46C H3 3.2281 no . 4_455
H46C H4 2.5055 no . 4_455
H46C H8 3.1495 no . 3_566
H46C H9 3.3032 no . 3_566
H46C H47C 3.4592 no . 3_566
H46C H67B 2.2975 no . 1_455
H46C H67C 3.1702 no . 1_455
H47A C25 3.2667 no . 3_566
H47A C63 3.4605 no . 1_455
H47A C64 3.3452 no . 1_455
H47A C66 3.3240 no . 1_455
H47A H25 2.6074 no . 3_566
H47A H64 3.0275 no . 1_455
H47A H66C 2.5296 no . 1_455
H47B H66C 3.5567 no . 1_455
H47B H77A 3.2782 no . 4_454
H47B H77C 3.4057 no . 4_454
H47C C24 3.5143 no . 3_566
H47C C46 3.4198 no . 3_566
H47C H24 3.0528 no . 3_566
H47C H25 3.1655 no . 3_566
H47C H46A 2.5942 no . 3_566
H47C H46C 3.4592 no . 3_566
H54 C6 3.2569 no . 2_545
H54 H6 2.7775 no . 2_545
H54 H67C 3.3972 no . 3_656
H54 H76B 3.2727 no . 3_556
H54 H76C 3.5085 no . 3_556
H54 H77B 3.5967 no . 3_656
H56A C56 3.3197 no . 3_656
H56A H56A 2.9293 no . 3_656
H56A H56B 2.8101 no . 3_656
H56A H66B 3.3553 no . 3_656
H56B N61 3.4499 no . 3_656
H56B N62 3.5123 no . 3_656
H56B N71 3.3199 no . 3_656
H56B C56 3.5912 no . 3_656
H56B C74 3.1567 no . 3_656
H56B C75 2.8739 no . 3_656
H56B C77 3.1607 no . 3_656
H56B H56A 2.8101 no . 3_656
H56B H56B 3.5120 no . 3_656
H56B H74 3.4457 no . 3_656
H56B H77B 2.6344 no . 3_656
H56B H77C 3.5289 no . 3_656
H56C N61 2.8975 no . 3_656
H56C N62 2.8001 no . 3_656
H56C C63 2.7175 no . 3_656
H56C C64 2.8077 no . 3_656
H56C C65 2.8979 no . 3_656
H56C C66 3.5080 no . 3_656
H56C H64 3.3097 no . 3_656
H56C H66B 3.1793 no . 3_656
H56C H77B 3.1079 no . 3_656
H57A C6 3.4701 no . 2_545
H57A C7 3.4899 no . 2_545
H57A C22 3.4754 no . 4_454
H57A C23 3.3931 no . 4_454
H57A H6 2.6213 no . 2_545
H57A H7 2.6509 no . 2_545
H57A H23 3.5467 no . 4_454
H57A H66C 3.4240 no . 1_455
H57A H76C 3.5605 no . 3_556
H57B C64 3.2647 no . 1_455
H57B C66 3.4672 no . 1_455
H57B H64 2.4914 no . 1_455
H57B H66B 3.5595 no . 1_455
H57B H66C 2.7918 no . 1_455
H57C C66 3.3420 no . 1_455
H57C C76 2.9831 no . 3_556
H57C H6 2.6864 no . 2_545
H57C H64 3.0683 no . 1_455
H57C H66B 2.9801 no . 1_455
H57C H66C 2.9694 no . 1_455
H57C H76A 2.6886 no . 3_556
H57C H76B 3.3617 no . 3_556
H57C H76C 2.4937 no . 3_556
H64 N41 3.3618 no . 1_655
H64 C44 3.2466 no . 1_655
H64 C45 3.0610 no . 1_655
H64 C47 3.5093 no . 1_655
H64 C57 3.1675 no . 1_655
H64 H44 3.5877 no . 1_655
H64 H47A 3.0275 no . 1_655
H64 H56C 3.3097 no . 3_656
H64 H57B 2.4914 no . 1_655
H64 H57C 3.0683 no . 1_655
H66A C26 3.3624 no . 3_666
H66A H23 2.9986 no . 4_554
H66A H25 3.1680 no . 3_666
H66A H26 2.5658 no . 3_666
H66B C23 3.5541 no . 4_554
H66B C73 3.5367 no . 3_656
H66B C74 3.3342 no . 3_656
H66B C76 3.1579 no . 3_656
H66B H23 2.7548 no . 4_554
H66B H56A 3.3553 no . 3_656
H66B H56C 3.1793 no . 3_656
H66B H57B 3.5595 no . 1_655
H66B H57C 2.9801 no . 1_655
H66B H74 2.7612 no . 3_656
H66B H76A 2.5907 no . 3_656
H66B H76C 3.0673 no . 3_656
H66C C23 3.3271 no . 4_554
H66C C47 3.4159 no . 1_655
H66C C57 3.2284 no . 1_655
H66C H23 2.5665 no . 4_554
H66C H25 3.0977 no . 3_666
H66C H26 3.4129 no . 3_666
H66C H47A 2.5296 no . 1_655
H66C H47B 3.5567 no . 1_655
H66C H57A 3.4240 no . 1_655
H66C H57B 2.7918 no . 1_655
H66C H57C 2.9694 no . 1_655
H67A C4 3.4983 no . 4_555
H67A C12 3.5620 no . 4_555
H67A C13 3.2925 no . 4_555
H67A H8 2.9919 no . 3_666
H67B C4 3.4218 no . 4_555
H67B C8 3.5809 no . 3_666
H67B C43 3.2349 no . 1_655
H67B C44 3.3245 no . 1_655
H67B C46 3.1057 no . 1_655
H67B H4 3.3776 no . 4_555
H67B H8 2.7255 no . 3_666
H67B H44 3.2059 no . 1_655
H67B H46C 2.2975 no . 1_655
H67C C4 3.2489 no . 4_555
H67C C5 2.8867 no . 4_555
H67C C6 3.5626 no . 4_555
H67C C13 3.0174 no . 4_555
H67C H4 3.2465 no . 4_555
H67C H5 2.8729 no . 4_555
H67C H46C 3.1702 no . 1_655
H67C H54 3.3972 no . 3_656
H74 C3 3.2147 no . 3_656
H74 C24 3.5946 no . 2_546
H74 C66 3.5980 no . 3_656
H74 H2 3.3889 no . 3_656
H74 H3 2.5321 no . 3_656
H74 H23 3.3819 no . 2_546
H74 H24 2.7900 no . 2_546
H74 H56B 3.4457 no . 3_656
H74 H66B 2.7612 no . 3_656
H76A C66 3.4354 no . 3_656
H76A H57C 2.6886 no . 3_556
H76A H66B 2.5907 no . 3_656
H76B C5 3.4464 no . 4_455
H76B H5 2.6164 no . 4_455
H76B H6 3.3947 no . 4_455
H76B H54 3.2727 no . 3_556
H76B H57C 3.3617 no . 3_556
H76C C5 3.1407 no . 4_455
H76C C6 3.1450 no . 4_455
H76C C24 3.4158 no . 2_546
H76C C57 3.3903 no . 3_556
H76C H5 2.5204 no . 4_455
H76C H6 2.5385 no . 4_455
H76C H24 2.8988 no . 2_546
H76C H54 3.5085 no . 3_556
H76C H57A 3.5605 no . 3_556
H76C H57C 2.4937 no . 3_556
H76C H66B 3.0673 no . 3_656
H77A N10 3.2873 no . 4_555
H77A C10 3.2873 no . 4_555
H77A C11 3.1614 no . 4_555
H77A C12 3.4104 no . 4_555
H77A H47B 3.2782 no . 4_555
H77B C11 3.5062 no . 4_555
H77B C14 3.3884 no . 4_555
H77B C53 3.4677 no . 3_656
H77B C56 3.1790 no . 3_656
H77B H54 3.5967 no . 3_656
H77B H56B 2.6344 no . 3_656
H77B H56C 3.1079 no . 3_656
H77C N10 3.0748 no . 4_555
H77C C7 3.1203 no . 4_555
H77C C8 3.0777 no . 4_555
H77C C9 3.0526 no . 4_555
H77C C10 3.0748 no . 4_555
H77C C11 3.0644 no . 4_555
H77C C14 3.1160 no . 4_555
H77C H2 3.2231 no . 3_656
H77C H3 3.1475 no . 3_656
H77C H8 3.5952 no . 4_555
H77C H9 3.5647 no . 4_555
H77C H47B 3.4057 no . 4_555
H77C H56B 3.5289 no . 3_656
_chemical_name_systematic        '[Pt2Ag2(bzq)2(Me2pz)4]'
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: chloroform/n-hexane'
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_3b
_database_code_depnum_ccdc_archive 'CCDC 1438724'
_audit_update_record             
;
2015-11-25 deposited with the CCDC.
2016-02-22 downloaded from the CCDC.
;
#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C26.5 H28 Au2 Cl F2 N7 Pt'
_chemical_formula_moiety         'C26 H27 Au2 F2 N7 Pt, C0.5 H Cl'
_chemical_formula_weight         1107.03
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_space_group_crystal_system      triclinic
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
_space_group_IT_number           2
loop_
_symmetry_equiv_pos_site_id
_space_group_symop_operation_xyz
1 +X,+Y,+Z
2 -X,-Y,-Z
#------------------------------------------------------------------------------
_cell_length_a                   11.388(2)
_cell_length_b                   11.5678(19)
_cell_length_c                   12.457(3)
_cell_angle_alpha                72.169(10)
_cell_angle_beta                 77.301(10)
_cell_angle_gamma                68.929(9)
_cell_volume                     1446.5(5)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    4299
_cell_measurement_theta_min      3.15
_cell_measurement_theta_max      27.47
_cell_measurement_temperature    293
#------------------------------------------------------------------------------
_exptl_crystal_description       prism
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.200
_exptl_crystal_density_diffrn    2.541
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1014.00
_exptl_absorpt_coefficient_mu    15.092
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_absorpt_correction_T_min  0.034
_exptl_absorpt_correction_T_max  0.049

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      293
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku Saturn724'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 7.111
_diffrn_reflns_number            12150
_diffrn_reflns_av_R_equivalents  0.0384
_diffrn_reflns_av_sigmaI/netI    0.0740
_diffrn_reflns_theta_max         27.470
_diffrn_reflns_theta_min         3.146
_diffrn_reflns_theta_full        27.470
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measured_fraction_theta_full 0.987
_diffrn_reflns_Laue_measured_fraction_max 0.000
_diffrn_reflns_Laue_measured_fraction_full 0.000
_diffrn_reflns_point_group_measured_fraction_max 0.000
_diffrn_reflns_point_group_measured_fraction_full 0.000
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             6546
_reflns_number_gt                4818
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_all          0.0666
_refine_ls_R_factor_gt           0.0435
_refine_ls_wR_factor_ref         0.0995
_refine_ls_wR_factor_gt          0.0892
_refine_ls_number_restraints     177
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         6546
_refine_ls_number_parameters     361
_refine_ls_goodness_of_fit_ref   1.004
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0464P)²+0.0000P] 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_diff_density_max         2.55
_refine_diff_density_min         -2.23
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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 for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(Vol. C, Table 6.1.1.4)
;
N N 0.0061 0.0033
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Au Au -2.0133 8.8022
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
F F 0.0171 0.0103
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Pt Pt -1.7033 8.3905
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Cl Cl 0.1484 0.1585
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.36293(3) 0.17887(3) 0.17775(3) 0.02206(10) Uani 1 2 d . . .
Au2 Au 0.10564(4) 0.19831(4) 0.13556(3) 0.02697(11) Uani 1 2 d . . .
Pt1 Pt 0.11113(3) 0.31538(3) 0.35286(3) 0.01767(10) Uani 1 2 d . . .
F23 F 0.1679(7) -0.0466(6) 0.7304(6) 0.051(2) Uani 1 2 d . . .
F25 F 0.5175(7) 0.0983(7) 0.5842(7) 0.057(2) Uani 1 2 d . . .
N11 N -0.0135(7) 0.2231(7) 0.4457(7) 0.0210(17) Uani 1 2 d . . .
N31 N 0.2488(9) 0.3979(8) 0.2756(8) 0.0343(13) Uani 1 2 d . . .
N32 N 0.3533(9) 0.3387(9) 0.2145(8) 0.0360(14) Uani 1 2 d . . .
N41 N -0.0119(8) 0.4223(8) 0.2295(8) 0.0326(14) Uani 1 2 d . . .
N42 N -0.0184(8) 0.3658(8) 0.1503(8) 0.0320(14) Uani 1 2 d . . .
N51 N 0.3585(10) 0.0232(9) 0.1413(9) 0.0496(16) Uani 1 2 d . . .
N52 N 0.2391(11) 0.0340(9) 0.1220(9) 0.0497(16) Uani 1 2 d . . .
C12 C 0.0267(9) 0.1357(8) 0.5445(8) 0.0177(19) Uani 1 2 d . . .
C13 C -0.0547(9) 0.0718(8) 0.6174(9) 0.025(2) Uani 1 2 d . . .
C14 C -0.1726(10) 0.0933(9) 0.5886(10) 0.028(2) Uani 1 2 d . . .
C15 C -0.2081(10) 0.1794(10) 0.4895(10) 0.033(3) Uani 1 2 d . . .
C16 C -0.1272(8) 0.2414(9) 0.4196(9) 0.022(2) Uani 1 2 d . . .
C21 C 0.2145(8) 0.2032(8) 0.4765(8) 0.0170(19) Uani 1 2 d . . .
C22 C 0.1547(9) 0.1219(9) 0.5603(8) 0.022(2) Uani 1 2 d . . .
C23 C 0.2240(11) 0.0334(10) 0.6478(10) 0.037(3) Uani 1 2 d . . .
C24 C 0.3464(10) 0.0231(10) 0.6563(10) 0.034(3) Uani 1 2 d . . .
C25 C 0.3990(11) 0.1055(11) 0.5742(10) 0.037(3) Uani 1 2 d . . .
C26 C 0.3377(9) 0.1940(9) 0.4852(9) 0.025(2) Uani 1 2 d . . .
C33 C 0.4398(12) 0.3995(11) 0.1915(10) 0.0412(15) Uani 1 2 d . . .
C34 C 0.3833(12) 0.5033(11) 0.2424(10) 0.0427(15) Uani 1 2 d . . .
C35 C 0.2686(12) 0.4983(11) 0.2938(10) 0.0393(15) Uani 1 2 d . . .
C36 C 0.5677(11) 0.3558(12) 0.1271(11) 0.051(2) Uani 1 2 d . . .
C37 C 0.1729(13) 0.5854(11) 0.3611(11) 0.051(2) Uani 1 2 d . . .
C43 C -0.1160(10) 0.4403(10) 0.0909(10) 0.0363(14) Uani 1 2 d . . .
C44 C -0.1739(10) 0.5474(11) 0.1330(10) 0.0409(15) Uani 1 2 d . . .
C45 C -0.1104(10) 0.5349(10) 0.2193(10) 0.0381(15) Uani 1 2 d . . .
C46 C -0.1432(10) 0.4076(11) -0.0041(10) 0.041(2) Uani 1 2 d . . .
C47 C -0.1303(11) 0.6222(11) 0.2946(11) 0.053(2) Uani 1 2 d . . .
C53 C 0.2481(14) -0.0759(12) 0.1010(11) 0.0552(16) Uani 1 2 d . . .
C54 C 0.3752(14) -0.1528(12) 0.1032(11) 0.0581(17) Uani 1 2 d . . .
C55 C 0.4393(14) -0.0912(11) 0.1292(11) 0.0553(17) Uani 1 2 d . . .
C56 C 0.1315(14) -0.0915(13) 0.0764(13) 0.070(2) Uani 1 2 d . . .
C57 C 0.5747(13) -0.1268(12) 0.1402(12) 0.064(3) Uani 1 2 d . . .
H2A H 0.40281 0.62893 0.4268 0.2041 Uiso 0.5 2 calc R . .
H2B H 0.48447 0.62445 0.51577 0.2041 Uiso 0.5 2 calc R . .
H13 H -0.02972 0.01466 0.68549 0.0301 Uiso 1 2 calc R . .
H14 H -0.22681 0.04981 0.63606 0.0337 Uiso 1 2 calc R . .
H15 H -0.28759 0.1959 0.46949 0.0393 Uiso 1 2 calc R . .
H16 H -0.15234 0.29827 0.35147 0.0268 Uiso 1 2 calc R . .
H24 H 0.39059 -0.03681 0.71476 0.0403 Uiso 1 2 calc R . .
H26 H 0.37841 0.24742 0.43098 0.0298 Uiso 1 2 calc R . .
H34 H 0.41956 0.56444 0.24043 0.0513 Uiso 1 2 calc R . .
H36A H 0.56508 0.39979 0.04814 0.0608 Uiso 1 2 calc R . .
H36B H 0.592 0.26536 0.13512 0.0608 Uiso 1 2 calc R . .
H36C H 0.62837 0.37426 0.15646 0.0608 Uiso 1 2 calc R . .
H37A H 0.10003 0.55654 0.38929 0.0613 Uiso 1 2 calc R . .
H37B H 0.14767 0.67073 0.31343 0.0613 Uiso 1 2 calc R . .
H37C H 0.20933 0.5849 0.42385 0.0613 Uiso 1 2 calc R . .
H44 H -0.24364 0.61581 0.10728 0.0490 Uiso 1 2 calc R . .
H46A H -0.15867 0.32658 0.02245 0.0496 Uiso 1 2 calc R . .
H46B H -0.07202 0.40246 -0.06242 0.0496 Uiso 1 2 calc R . .
H46C H -0.21688 0.4724 -0.03445 0.0496 Uiso 1 2 calc R . .
H47A H -0.07073 0.66914 0.26713 0.0632 Uiso 1 2 calc R . .
H47B H -0.11791 0.57215 0.37086 0.0632 Uiso 1 2 calc R . .
H47C H -0.21509 0.68094 0.2937 0.0632 Uiso 1 2 calc R . .
H54 H 0.40905 -0.2335 0.08889 0.0697 Uiso 1 2 calc R . .
H56A H 0.14147 -0.0929 -0.00175 0.0835 Uiso 1 2 calc R . .
H56B H 0.05863 -0.02122 0.091 0.0835 Uiso 1 2 calc R . .
H56C H 0.12019 -0.17028 0.12444 0.0835 Uiso 1 2 calc R . .
H57A H 0.62454 -0.17644 0.08721 0.0765 Uiso 1 2 calc R . .
H57B H 0.58987 -0.17631 0.21614 0.0765 Uiso 1 2 calc R . .
H57C H 0.59792 -0.05069 0.12446 0.0765 Uiso 1 2 calc R . .
C2 C 0.477(4) 0.578(2) 0.466(4) 0.17(3) Uiso 0.5 2 d . . .
Cl1 Cl 0.4597(10) 0.4266(9) 0.5473(8) 0.078(2) Uiso 0.5 2 d . . .
Cl2 Cl 0.6149(8) 0.5479(8) 0.3670(7) 0.072(2) Uiso 0.5 2 d . . .



#==============================================================================
_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
_computing_cell_refinement       CrystalClear
_computing_data_reduction        CrystalClear
_computing_structure_solution    'Il Milione (Burla, et al., 2007)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_publication_material  'CrystalStructure 4.1 (Rigaku, 2014)'
_computing_molecular_graphics    'CrystalStructure 4.1'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Au1 N32 1.998(11) yes . .
Au1 N51 2.007(12) yes . .
Au2 N42 1.980(8) yes . .
Au2 N52 1.990(9) yes . .
Pt1 N11 2.026(8) yes . .
Pt1 N31 2.036(10) yes . .
Pt1 N41 2.095(9) yes . .
Pt1 C21 1.980(9) yes . .
F23 C23 1.369(13) yes . .
F25 C25 1.353(16) yes . .
N11 C12 1.377(11) yes . .
N11 C16 1.332(14) yes . .
N31 N32 1.341(12) yes . .
N31 C35 1.351(19) yes . .
N32 C33 1.340(19) yes . .
N41 N42 1.366(16) yes . .
N41 C45 1.372(12) yes . .
N42 C43 1.344(13) yes . .
N51 N52 1.388(18) yes . .
N51 C55 1.344(15) yes . .
N52 C53 1.339(19) yes . .
C12 C13 1.394(14) yes . .
C12 C22 1.459(15) yes . .
C13 C14 1.382(17) yes . .
C14 C15 1.362(14) yes . .
C15 C16 1.363(15) yes . .
C21 C22 1.408(13) yes . .
C21 C26 1.394(15) yes . .
C22 C23 1.405(14) yes . .
C23 C24 1.381(19) yes . .
C24 C25 1.363(16) yes . .
C25 C26 1.376(14) yes . .
C33 C34 1.411(18) yes . .
C33 C36 1.492(16) yes . .
C34 C35 1.336(18) yes . .
C35 C37 1.494(17) yes . .
C43 C44 1.379(17) yes . .
C43 C46 1.47(2) yes . .
C44 C45 1.368(19) yes . .
C45 C47 1.51(2) yes . .
C53 C54 1.402(19) yes . .
C53 C56 1.51(3) yes . .
C54 C55 1.33(3) yes . .
C55 C57 1.47(2) yes . .
C2 Cl1 1.79(3) yes . .
C2 Cl2 1.77(4) yes . .
C13 H13 0.930 no . .
C14 H14 0.930 no . .
C15 H15 0.930 no . .
C16 H16 0.930 no . .
C24 H24 0.930 no . .
C26 H26 0.930 no . .
C34 H34 0.930 no . .
C36 H36A 0.960 no . .
C36 H36B 0.960 no . .
C36 H36C 0.960 no . .
C37 H37A 0.960 no . .
C37 H37B 0.960 no . .
C37 H37C 0.960 no . .
C44 H44 0.930 no . .
C46 H46A 0.960 no . .
C46 H46B 0.960 no . .
C46 H46C 0.960 no . .
C47 H47A 0.960 no . .
C47 H47B 0.960 no . .
C47 H47C 0.960 no . .
C54 H54 0.930 no . .
C56 H56A 0.960 no . .
C56 H56B 0.960 no . .
C56 H56C 0.960 no . .
C57 H57A 0.960 no . .
C57 H57B 0.960 no . .
C57 H57C 0.960 no . .
H2A C2 0.970 no . .
H2B C2 0.970 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
N32 Au1 N51 175.7(4) yes . . .
N42 Au2 N52 176.3(5) yes . . .
N11 Pt1 N31 173.1(4) yes . . .
N11 Pt1 N41 91.9(3) yes . . .
N11 Pt1 C21 81.9(4) yes . . .
N31 Pt1 N41 94.9(4) yes . . .
N31 Pt1 C21 91.3(4) yes . . .
N41 Pt1 C21 173.7(4) yes . . .
Pt1 N11 C12 114.7(7) yes . . .
Pt1 N11 C16 125.8(6) yes . . .
C12 N11 C16 119.5(8) yes . . .
Pt1 N31 N32 121.6(8) yes . . .
Pt1 N31 C35 129.0(7) yes . . .
N32 N31 C35 107.8(10) yes . . .
Au1 N32 N31 119.4(9) yes . . .
Au1 N32 C33 130.2(8) yes . . .
N31 N32 C33 110.3(11) yes . . .
Pt1 N41 N42 118.6(5) yes . . .
Pt1 N41 C45 133.5(9) yes . . .
N42 N41 C45 106.6(9) yes . . .
Au2 N42 N41 120.7(6) yes . . .
Au2 N42 C43 129.3(9) yes . . .
N41 N42 C43 110.0(9) yes . . .
Au1 N51 N52 112.9(7) yes . . .
Au1 N51 C55 138.2(11) yes . . .
N52 N51 C55 108.8(13) yes . . .
Au2 N52 N51 114.8(9) yes . . .
Au2 N52 C53 137.9(11) yes . . .
N51 N52 C53 107.2(10) yes . . .
N11 C12 C13 119.2(9) yes . . .
N11 C12 C22 113.7(8) yes . . .
C13 C12 C22 127.1(8) yes . . .
C12 C13 C14 120.0(9) yes . . .
C13 C14 C15 118.9(10) yes . . .
C14 C15 C16 120.2(11) yes . . .
N11 C16 C15 122.2(9) yes . . .
Pt1 C21 C22 113.8(7) yes . . .
Pt1 C21 C26 127.1(6) yes . . .
C22 C21 C26 119.0(8) yes . . .
C12 C22 C21 115.8(8) yes . . .
C12 C22 C23 126.3(9) yes . . .
C21 C22 C23 117.8(10) yes . . .
F23 C23 C22 119.0(11) yes . . .
F23 C23 C24 117.6(9) yes . . .
C22 C23 C24 123.4(10) yes . . .
C23 C24 C25 116.3(10) yes . . .
F25 C25 C24 116.4(10) yes . . .
F25 C25 C26 119.9(10) yes . . .
C24 C25 C26 123.7(12) yes . . .
C21 C26 C25 119.7(10) yes . . .
N32 C33 C34 105.4(10) yes . . .
N32 C33 C36 123.5(12) yes . . .
C34 C33 C36 131.1(14) yes . . .
C33 C34 C35 107.8(13) yes . . .
N31 C35 C34 108.6(11) yes . . .
N31 C35 C37 122.9(12) yes . . .
C34 C35 C37 128.4(14) yes . . .
N42 C43 C44 107.2(12) yes . . .
N42 C43 C46 122.5(10) yes . . .
C44 C43 C46 130.1(10) yes . . .
C43 C44 C45 107.8(9) yes . . .
N41 C45 C44 108.3(11) yes . . .
N41 C45 C47 120.4(11) yes . . .
C44 C45 C47 131.3(9) yes . . .
N52 C53 C54 107.2(15) yes . . .
N52 C53 C56 118.9(11) yes . . .
C54 C53 C56 133.8(14) yes . . .
C53 C54 C55 108.6(13) yes . . .
N51 C55 C54 108.1(13) yes . . .
N51 C55 C57 120.8(15) yes . . .
C54 C55 C57 131.1(12) yes . . .
Cl1 C2 Cl2 107.4(15) yes . . .
C12 C13 H13 119.991 no . . .
C14 C13 H13 119.986 no . . .
C13 C14 H14 120.555 no . . .
C15 C14 H14 120.564 no . . .
C14 C15 H15 119.912 no . . .
C16 C15 H15 119.917 no . . .
N11 C16 H16 118.925 no . . .
C15 C16 H16 118.920 no . . .
C23 C24 H24 121.851 no . . .
C25 C24 H24 121.853 no . . .
C21 C26 H26 120.128 no . . .
C25 C26 H26 120.131 no . . .
C33 C34 H34 126.080 no . . .
C35 C34 H34 126.093 no . . .
C33 C36 H36A 109.472 no . . .
C33 C36 H36B 109.474 no . . .
C33 C36 H36C 109.468 no . . .
H36A C36 H36B 109.473 no . . .
H36A C36 H36C 109.470 no . . .
H36B C36 H36C 109.471 no . . .
C35 C37 H37A 109.472 no . . .
C35 C37 H37B 109.468 no . . .
C35 C37 H37C 109.472 no . . .
H37A C37 H37B 109.467 no . . .
H37A C37 H37C 109.475 no . . .
H37B C37 H37C 109.472 no . . .
C43 C44 H44 126.081 no . . .
C45 C44 H44 126.099 no . . .
C43 C46 H46A 109.473 no . . .
C43 C46 H46B 109.465 no . . .
C43 C46 H46C 109.466 no . . .
H46A C46 H46B 109.477 no . . .
H46A C46 H46C 109.473 no . . .
H46B C46 H46C 109.474 no . . .
C45 C47 H47A 109.468 no . . .
C45 C47 H47B 109.471 no . . .
C45 C47 H47C 109.462 no . . .
H47A C47 H47B 109.473 no . . .
H47A C47 H47C 109.478 no . . .
H47B C47 H47C 109.475 no . . .
C53 C54 H54 125.683 no . . .
C55 C54 H54 125.679 no . . .
C53 C56 H56A 109.469 no . . .
C53 C56 H56B 109.470 no . . .
C53 C56 H56C 109.470 no . . .
H56A C56 H56B 109.466 no . . .
H56A C56 H56C 109.481 no . . .
H56B C56 H56C 109.472 no . . .
C55 C57 H57A 109.472 no . . .
C55 C57 H57B 109.475 no . . .
C55 C57 H57C 109.467 no . . .
H57A C57 H57B 109.474 no . . .
H57A C57 H57C 109.466 no . . .
H57B C57 H57C 109.473 no . . .
H2A C2 H2B 108.501 no . . .
H2A C2 Cl1 110.231 no . . .
H2A C2 Cl2 110.228 no . . .
H2B C2 Cl1 110.220 no . . .
H2B C2 Cl2 110.225 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
N11 Pt1 N41 N42 -79.4(6) no . . . .
N11 Pt1 N41 C45 86.0(8) no . . . .
N41 Pt1 N11 C12 -179.4(6) no . . . .
N41 Pt1 N11 C16 -0.2(7) no . . . .
N11 Pt1 C21 C22 0.1(6) no . . . .
N11 Pt1 C21 C26 177.2(8) no . . . .
C21 Pt1 N11 C12 1.6(6) no . . . .
C21 Pt1 N11 C16 -179.1(7) no . . . .
N31 Pt1 N41 N42 101.6(6) no . . . .
N31 Pt1 N41 C45 -93.0(8) no . . . .
N41 Pt1 N31 N32 -101.6(7) no . . . .
N41 Pt1 N31 C35 94.4(7) no . . . .
N31 Pt1 C21 C22 178.9(6) no . . . .
N31 Pt1 C21 C26 -3.9(8) no . . . .
C21 Pt1 N31 N32 77.4(7) no . . . .
C21 Pt1 N31 C35 -86.5(7) no . . . .
Pt1 N11 C12 C13 176.7(6) no . . . .
Pt1 N11 C12 C22 -2.9(10) no . . . .
Pt1 N11 C16 C15 -176.9(6) no . . . .
C12 N11 C16 C15 2.3(15) no . . . .
C16 N11 C12 C13 -2.6(14) no . . . .
C16 N11 C12 C22 177.8(8) no . . . .
Pt1 N31 N32 Au1 9.8(11) no . . . .
Pt1 N31 N32 C33 -167.9(5) no . . . .
Pt1 N31 C35 C34 167.1(6) no . . . .
Pt1 N31 C35 C37 -13.1(15) no . . . .
N32 N31 C35 C34 1.4(11) no . . . .
N32 N31 C35 C37 -178.8(8) no . . . .
C35 N31 N32 Au1 176.8(7) no . . . .
C35 N31 N32 C33 -0.9(10) no . . . .
Au1 N32 C33 C34 -177.3(6) no . . . .
Au1 N32 C33 C36 1.3(15) no . . . .
N31 N32 C33 C34 0.0(11) no . . . .
N31 N32 C33 C36 178.6(8) no . . . .
Pt1 N41 N42 Au2 -10.4(10) no . . . .
Pt1 N41 N42 C43 169.9(5) no . . . .
Pt1 N41 C45 C44 -168.0(6) no . . . .
Pt1 N41 C45 C47 13.7(15) no . . . .
N42 N41 C45 C44 -1.3(11) no . . . .
N42 N41 C45 C47 -179.6(8) no . . . .
C45 N41 N42 Au2 -179.4(7) no . . . .
C45 N41 N42 C43 0.9(10) no . . . .
Au2 N42 C43 C44 -179.8(6) no . . . .
Au2 N42 C43 C46 -2.7(15) no . . . .
N41 N42 C43 C44 -0.1(11) no . . . .
N41 N42 C43 C46 177.0(8) no . . . .
Au1 N51 N52 Au2 -0.1(9) no . . . .
Au1 N51 N52 C53 -178.8(5) no . . . .
Au1 N51 C55 C54 -179.7(7) no . . . .
Au1 N51 C55 C57 -2.2(18) no . . . .
N52 N51 C55 C54 -0.1(12) no . . . .
N52 N51 C55 C57 177.4(9) no . . . .
C55 N51 N52 Au2 -179.8(8) no . . . .
C55 N51 N52 C53 1.5(11) no . . . .
Au2 N52 C53 C54 179.6(8) no . . . .
Au2 N52 C53 C56 1.9(18) no . . . .
N51 N52 C53 C54 -2.2(12) no . . . .
N51 N52 C53 C56 -179.9(9) no . . . .
N11 C12 C13 C14 2.1(14) no . . . .
N11 C12 C22 C21 3.0(13) no . . . .
N11 C12 C22 C23 -174.7(8) no . . . .
C13 C12 C22 C21 -176.6(9) no . . . .
C13 C12 C22 C23 5.7(17) no . . . .
C22 C12 C13 C14 -178.3(9) no . . . .
C12 C13 C14 C15 -1.3(16) no . . . .
C13 C14 C15 C16 1.0(17) no . . . .
C14 C15 C16 N11 -1.5(17) no . . . .
Pt1 C21 C22 C12 -1.6(11) no . . . .
Pt1 C21 C22 C23 176.2(6) no . . . .
Pt1 C21 C26 C25 -176.4(6) no . . . .
C22 C21 C26 C25 0.6(15) no . . . .
C26 C21 C22 C12 -179.0(8) no . . . .
C26 C21 C22 C23 -1.1(14) no . . . .
C12 C22 C23 F23 -2.4(17) no . . . .
C12 C22 C23 C24 178.3(9) no . . . .
C21 C22 C23 F23 179.9(9) no . . . .
C21 C22 C23 C24 0.6(17) no . . . .
F23 C23 C24 C25 -178.8(9) no . . . .
C22 C23 C24 C25 0.5(18) no . . . .
C23 C24 C25 F25 178.0(10) no . . . .
C23 C24 C25 C26 -1.1(19) no . . . .
F25 C25 C26 C21 -178.5(9) no . . . .
C24 C25 C26 C21 0.6(19) no . . . .
N32 C33 C34 C35 0.8(12) no . . . .
C36 C33 C34 C35 -177.6(11) no . . . .
C33 C34 C35 N31 -1.4(12) no . . . .
C33 C34 C35 C37 178.8(9) no . . . .
N42 C43 C44 C45 -0.7(12) no . . . .
C46 C43 C44 C45 -177.5(10) no . . . .
C43 C44 C45 N41 1.3(12) no . . . .
C43 C44 C45 C47 179.3(10) no . . . .
N52 C53 C54 C55 2.2(13) no . . . .
C56 C53 C54 C55 179.4(13) no . . . .
C53 C54 C55 N51 -1.3(14) no . . . .
C53 C54 C55 C57 -178.4(11) no . . . .

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
Au1 Au2 3.0070(9) no . .
Au1 Pt1 3.4026(7) no . .
Au1 C36 3.467(16) no . .
Au1 C57 3.594(13) no . .
Au2 Pt1 3.3979(9) no . .
Au2 C46 3.402(10) no . .
Au2 C56 3.546(18) no . .
Pt1 C37 3.474(16) no . .
F23 C12 2.933(11) no . .
F23 C13 2.859(13) no . .
F23 C25 3.576(15) no . .
F25 C23 3.555(16) no . .
N11 N42 3.546(12) no . .
N11 C14 2.758(13) no . .
N31 C26 3.014(12) no . .
N32 C21 3.462(12) no . .
N32 C26 3.270(13) no . .
N41 C16 3.048(12) no . .
N42 C16 3.370(12) no . .
C12 C15 2.737(16) no . .
C13 C16 2.715(13) no . .
C13 C23 3.135(18) no . .
C16 C45 3.587(14) no . .
C21 C24 2.825(13) no . .
C22 C25 2.759(17) no . .
C23 C26 2.740(15) no . .
C26 C35 3.520(13) no . .
C37 C47 3.57(2) no . .
F23 C15 3.405(16) no . 2_556
F23 C16 3.534(15) no . 2_556
F25 C14 3.521(14) no . 1_655
F25 C15 3.442(14) no . 1_655
F25 C24 3.509(15) no . 2_656
F25 C25 3.281(16) no . 2_656
F25 C26 3.471(13) no . 2_656
F25 C57 3.443(17) no . 2_656
F25 Cl1 3.512(13) no . .
N11 C13 3.511(14) no . 2_556
N11 C37 3.528(16) no . 2_566
N41 C46 3.436(14) no . 2_565
N42 C43 3.566(13) no . 2_565
N42 C46 3.557(16) no . 2_565
N51 C57 3.350(16) no . 2_655
N52 C13 3.587(14) no . 2_556
N52 C14 3.478(14) no . 2_556
N52 C57 3.572(16) no . 2_655
C12 C13 3.473(17) no . 2_556
C12 C14 3.293(15) no . 2_556
C12 C15 3.588(14) no . 2_556
C12 C37 3.582(15) no . 2_566
C13 N11 3.511(14) no . 2_556
C13 N52 3.587(14) no . 2_556
C13 C12 3.473(17) no . 2_556
C13 C13 3.571(16) no . 2_556
C13 C16 3.583(13) no . 2_556
C14 F25 3.521(14) no . 1_455
C14 N52 3.478(14) no . 2_556
C14 C12 3.293(15) no . 2_556
C14 C22 3.461(18) no . 2_556
C15 F23 3.405(16) no . 2_556
C15 F25 3.442(14) no . 1_455
C15 C12 3.588(14) no . 2_556
C15 C22 3.541(16) no . 2_556
C15 C23 3.47(2) no . 2_556
C16 F23 3.534(15) no . 2_556
C16 C13 3.583(13) no . 2_556
C22 C14 3.461(18) no . 2_556
C22 C15 3.541(16) no . 2_556
C23 C15 3.47(2) no . 2_556
C24 F25 3.509(15) no . 2_656
C24 C57 3.51(2) no . 2_656
C25 F25 3.281(16) no . 2_656
C25 C25 3.394(17) no . 2_656
C26 F25 3.471(13) no . 2_656
C34 Cl2 3.591(19) no . .
C36 C46 3.509(17) no . 1_655
C37 N11 3.528(16) no . 2_566
C37 C12 3.582(15) no . 2_566
C43 N42 3.566(13) no . 2_565
C43 C43 3.476(16) no . 2_565
C45 C46 3.585(15) no . 2_565
C46 N41 3.436(14) no . 2_565
C46 N42 3.557(16) no . 2_565
C46 C36 3.509(17) no . 1_455
C46 C45 3.585(15) no . 2_565
C55 C55 3.565(18) no . 2_655
C55 C57 3.523(17) no . 2_655
C56 C56 3.54(2) no . 2_555
C57 F25 3.443(17) no . 2_656
C57 N51 3.350(16) no . 2_655
C57 N52 3.572(16) no . 2_655
C57 C24 3.51(2) no . 2_656
C57 C55 3.523(17) no . 2_655
Cl1 F25 3.512(13) no . .
Cl2 C34 3.591(19) no . .
Au1 H26 3.5338 no . .
Au1 H36B 3.0050 no . .
Au1 H57C 3.1372 no . .
Au2 H46A 3.2587 no . .
Au2 H46B 3.3081 no . .
Au2 H56B 3.0025 no . .
Pt1 H16 3.0811 no . .
Pt1 H26 3.1532 no . .
Pt1 H37A 2.9156 no . .
Pt1 H47B 3.2025 no . .
F23 H13 2.2457 no . .
F23 H24 2.5412 no . .
F25 H24 2.4921 no . .
F25 H26 2.5448 no . .
N11 H13 3.2301 no . .
N11 H15 3.1894 no . .
N31 H26 2.5107 no . .
N31 H34 3.0804 no . .
N31 H37A 2.5585 no . .
N31 H37B 3.0933 no . .
N31 H37C 3.1108 no . .
N32 H26 2.6161 no . .
N32 H34 3.0876 no . .
N32 H36A 2.9569 no . .
N32 H36B 2.6001 no . .
N32 H36C 3.2020 no . .
N41 H16 2.4844 no . .
N41 H37A 3.5259 no . .
N41 H44 3.1186 no . .
N41 H47A 2.8513 no . .
N41 H47B 2.6449 no . .
N41 H47C 3.2591 no . .
N42 H16 2.6819 no . .
N42 H44 3.0903 no . .
N42 H46A 2.7156 no . .
N42 H46B 2.7224 no . .
N42 H46C 3.2356 no . .
N51 H54 3.0609 no . .
N51 H57A 3.1606 no . .
N51 H57B 2.9199 no . .
N51 H57C 2.5278 no . .
N52 H54 3.1002 no . .
N52 H56A 3.0126 no . .
N52 H56B 2.4945 no . .
N52 H56C 3.1071 no . .
C12 H14 3.2468 no . .
C12 H16 3.1785 no . .
C13 H15 3.2061 no . .
C14 H16 3.1942 no . .
C15 H13 3.2036 no . .
C16 H14 3.2045 no . .
C22 H13 2.7628 no . .
C22 H24 3.2943 no . .
C22 H26 3.2577 no . .
C23 H13 2.8995 no . .
C24 H26 3.2426 no . .
C26 H24 3.2550 no . .
C33 H26 3.0394 no . .
C34 H26 3.1765 no . .
C34 H36A 3.0599 no . .
C34 H36B 3.3411 no . .
C34 H36C 2.7984 no . .
C34 H37A 3.2868 no . .
C34 H37B 2.8290 no . .
C34 H37C 2.8142 no . .
C35 H26 2.8635 no . .
C36 H34 2.9625 no . .
C37 H34 2.8440 no . .
C37 H47A 2.9672 no . .
C37 H47B 3.3434 no . .
C43 H16 3.1690 no . .
C44 H16 3.2793 no . .
C44 H46A 3.1906 no . .
C44 H46B 3.1527 no . .
C44 H46C 2.6842 no . .
C44 H47A 3.1065 no . .
C44 H47B 3.2789 no . .
C44 H47C 2.7524 no . .
C45 H16 2.8756 no . .
C46 H44 2.8989 no . .
C47 H37A 2.8688 no . .
C47 H37B 3.4753 no . .
C47 H44 2.9347 no . .
C54 H56A 2.9871 no . .
C54 H56B 3.3896 no . .
C54 H56C 2.9318 no . .
C54 H57A 2.7209 no . .
C54 H57B 2.9713 no . .
C54 H57C 3.2464 no . .
C56 H54 3.0063 no . .
C57 H54 2.8600 no . .
H13 H14 2.3195 no . .
H14 H15 2.2986 no . .
H15 H16 2.2772 no . .
H16 H47B 3.4136 no . .
H34 H36A 3.3001 no . .
H34 H36C 2.8535 no . .
H34 H37B 2.9385 no . .
H34 H37C 2.9201 no . .
H37A H47A 2.4616 no . .
H37A H47B 2.4795 no . .
H37B H47A 2.6812 no . .
H37B H47B 3.4623 no . .
H44 H46A 3.5546 no . .
H44 H46B 3.5057 no . .
H44 H46C 2.6750 no . .
H44 H47A 3.4018 no . .
H44 H47C 2.7651 no . .
H54 H56A 3.1669 no . .
H54 H56C 3.0626 no . .
H54 H57A 2.7553 no . .
H54 H57B 3.2011 no . .
Au1 H14 3.5200 no . 2_556
Au1 H24 3.0594 no . 2_656
Au1 H57A 3.2806 no . 2_655
Au2 H13 3.0178 no . 2_556
Au2 H14 3.4804 no . 2_556
Au2 H44 3.5497 no . 2_565
F23 H15 3.2383 no . 2_556
F23 H16 3.4369 no . 2_556
F23 H36B 3.3359 no . 2_656
F23 H56A 3.1770 no . 1_556
F23 H56B 3.0516 no . 2_556
F25 H14 2.9394 no . 1_655
F25 H15 2.7681 no . 1_655
F25 H57B 2.7823 no . 2_656
F25 H57C 3.5217 no . 2_656
N11 H13 3.4503 no . 2_556
N11 H37A 3.4935 no . 2_566
N11 H37B 3.4257 no . 2_566
N11 H37C 3.0987 no . 2_566
N31 H46B 3.4184 no . 2_565
N31 H46C 2.9549 no . 2_565
N32 H46C 2.8830 no . 2_565
N41 H46B 2.6996 no . 2_565
N41 H46C 3.4437 no . 2_565
N42 H46B 3.0230 no . 2_565
N51 H14 2.8812 no . 2_556
N51 H57A 2.8632 no . 2_655
N51 H57C 3.1710 no . 2_655
N52 H13 3.0626 no . 2_556
N52 H14 2.8581 no . 2_556
N52 H57A 3.0574 no . 2_655
N52 H57C 3.2083 no . 2_655
C12 H14 3.4701 no . 2_556
C12 H37B 3.1265 no . 2_566
C12 H37C 3.4488 no . 2_566
C13 H37B 3.1042 no . 2_566
C13 H56B 3.4906 no . 2_556
C13 H56C 3.5740 no . 2_556
C14 H37B 3.4305 no . 2_566
C14 H37C 3.5508 no . 2_566
C15 H37C 3.2197 no . 2_566
C16 H13 3.3496 no . 2_556
C16 H37C 2.9938 no . 2_566
C21 H14 3.5615 no . 2_556
C21 H47B 3.4102 no . 2_566
C21 H47C 3.5146 no . 2_566
C22 H14 3.3944 no . 2_556
C22 H15 3.5400 no . 2_556
C22 H47A 3.4635 no . 2_566
C23 H15 3.1973 no . 2_556
C23 H47C 3.5584 no . 2_566
C24 H36B 3.4908 no . 2_656
C24 H47C 3.4005 no . 2_566
C24 H57B 3.0580 no . 2_656
C24 H57C 3.0668 no . 2_656
C25 H47C 3.2331 no . 2_566
C25 H57B 3.0070 no . 2_656
C26 H47B 3.5959 no . 2_566
C26 H47C 3.3060 no . 2_566
C33 H36A 3.1684 no . 2_665
C33 H46C 3.1885 no . 2_565
C34 H2A 3.1525 no . .
C34 H36A 3.4281 no . 2_665
C34 H46C 3.4221 no . 2_565
C34 H54 3.1365 no . 1_565
C35 H2A 3.4162 no . .
C35 H46C 3.3050 no . 2_565
C36 H24 3.5249 no . 2_656
C36 H36A 3.1048 no . 2_665
C36 H46A 3.0411 no . 1_655
C36 H46C 3.2296 no . 1_655
C36 H54 3.3253 no . 2_655
C37 H2A 3.1502 no . .
C37 H47B 3.3220 no . 2_566
C37 H56C 3.3904 no . 1_565
C43 H36C 3.1464 no . 1_455
C43 H46B 3.1760 no . 2_565
C44 H36C 3.4296 no . 1_455
C44 H46B 2.9535 no . 2_565
C44 H57A 3.1605 no . 1_465
C45 H46B 2.6622 no . 2_565
C46 H36A 3.2700 no . 1_455
C46 H36C 2.9792 no . 1_455
C46 H56C 3.4176 no . 2_555
C47 H46B 3.2952 no . 2_565
C47 H57B 3.3426 no . 1_465
C53 H13 3.2772 no . 2_556
C53 H14 3.3296 no . 2_556
C53 H57C 3.2047 no . 2_655
C54 H34 3.1053 no . 1_545
C54 H36B 3.4900 no . 2_655
C54 H57C 3.1188 no . 2_655
C55 H14 3.3979 no . 2_556
C55 H57A 3.3933 no . 2_655
C55 H57C 3.1261 no . 2_655
C56 H13 3.2080 no . 2_556
C56 H37B 3.3491 no . 1_545
C56 H46A 3.2074 no . 2_555
C56 H56A 3.2198 no . 2_555
C56 H56B 3.0048 no . 2_555
C57 H24 3.1537 no . 2_656
C57 H44 3.0433 no . 1_645
C57 H47C 3.1486 no . 1_645
H2A C34 3.1525 no . .
H2A C35 3.4162 no . .
H2A C37 3.1502 no . .
H2A H34 2.5974 no . .
H2A H37B 3.3235 no . .
H2A H37C 2.4432 no . .
H13 Au2 3.0178 no . 2_556
H13 N11 3.4503 no . 2_556
H13 N52 3.0626 no . 2_556
H13 C16 3.3496 no . 2_556
H13 C53 3.2772 no . 2_556
H13 C56 3.2080 no . 2_556
H13 H16 3.5803 no . 2_556
H13 H37B 3.3994 no . 2_566
H13 H56B 2.7522 no . 2_556
H13 H56C 3.1800 no . 2_556
H14 Au1 3.5200 no . 2_556
H14 Au2 3.4804 no . 2_556
H14 F25 2.9394 no . 1_455
H14 N51 2.8812 no . 2_556
H14 N52 2.8581 no . 2_556
H14 C12 3.4701 no . 2_556
H14 C21 3.5615 no . 2_556
H14 C22 3.3944 no . 2_556
H14 C53 3.3296 no . 2_556
H14 C55 3.3979 no . 2_556
H15 F23 3.2383 no . 2_556
H15 F25 2.7681 no . 1_455
H15 C22 3.5400 no . 2_556
H15 C23 3.1973 no . 2_556
H16 F23 3.4369 no . 2_556
H16 H13 3.5803 no . 2_556
H16 H36C 3.5624 no . 1_455
H16 H37C 3.3119 no . 2_566
H24 Au1 3.0594 no . 2_656
H24 C36 3.5249 no . 2_656
H24 C57 3.1537 no . 2_656
H24 H26 3.4860 no . 2_656
H24 H36B 2.6990 no . 2_656
H24 H57B 2.9405 no . 2_656
H24 H57C 2.5505 no . 2_656
H26 H24 3.4860 no . 2_656
H26 Cl1 3.3258 no . .
H34 C54 3.1053 no . 1_565
H34 H2A 2.5974 no . .
H34 H36A 3.4625 no . 2_665
H34 H54 2.4974 no . 1_565
H34 C2 3.0823 no . .
H34 Cl2 2.9188 no . .
H36A C33 3.1684 no . 2_665
H36A C34 3.4281 no . 2_665
H36A C36 3.1048 no . 2_665
H36A C46 3.2700 no . 1_655
H36A H34 3.4625 no . 2_665
H36A H36A 2.3703 no . 2_665
H36A H36C 3.5255 no . 2_665
H36A H46A 2.9195 no . 1_655
H36A H46C 2.7886 no . 1_655
H36A H54 2.8431 no . 2_655
H36B F23 3.3359 no . 2_656
H36B C24 3.4908 no . 2_656
H36B C54 3.4900 no . 2_655
H36B H24 2.6990 no . 2_656
H36B H46A 3.1013 no . 1_655
H36B H54 2.9276 no . 2_655
H36B H56A 3.3781 no . 2_655
H36C C43 3.1464 no . 1_655
H36C C44 3.4296 no . 1_655
H36C C46 2.9792 no . 1_655
H36C H16 3.5624 no . 1_655
H36C H36A 3.5255 no . 2_665
H36C H44 3.4343 no . 1_655
H36C H46A 2.6066 no . 1_655
H36C H46C 2.8271 no . 1_655
H37A N11 3.4935 no . 2_566
H37A H37A 3.4176 no . 2_566
H37A H47B 2.9172 no . 2_566
H37B N11 3.4257 no . 2_566
H37B C12 3.1265 no . 2_566
H37B C13 3.1042 no . 2_566
H37B C14 3.4305 no . 2_566
H37B C56 3.3491 no . 1_565
H37B H2A 3.3235 no . .
H37B H13 3.3994 no . 2_566
H37B H56C 2.5063 no . 1_565
H37C N11 3.0987 no . 2_566
H37C C12 3.4488 no . 2_566
H37C C14 3.5508 no . 2_566
H37C C15 3.2197 no . 2_566
H37C C16 2.9938 no . 2_566
H37C H2A 2.4432 no . .
H37C H16 3.3119 no . 2_566
H37C H47B 2.8755 no . 2_566
H37C C2 3.1697 no . .
H37C Cl1 3.2092 no . .
H44 Au2 3.5497 no . 2_565
H44 C57 3.0433 no . 1_465
H44 H36C 3.4343 no . 1_455
H44 H46B 3.4527 no . 2_565
H44 H57A 2.3009 no . 1_465
H44 H57B 2.9673 no . 1_465
H46A C36 3.0411 no . 1_455
H46A C56 3.2074 no . 2_555
H46A H36A 2.9195 no . 1_455
H46A H36B 3.1013 no . 1_455
H46A H36C 2.6066 no . 1_455
H46A H56A 2.7269 no . 2_555
H46A H56C 2.8130 no . 2_555
H46B N31 3.4184 no . 2_565
H46B N41 2.6996 no . 2_565
H46B N42 3.0230 no . 2_565
H46B C43 3.1760 no . 2_565
H46B C44 2.9535 no . 2_565
H46B C45 2.6622 no . 2_565
H46B C47 3.2952 no . 2_565
H46B H44 3.4527 no . 2_565
H46B H47A 2.8869 no . 2_565
H46B H56C 3.2600 no . 2_555
H46C N31 2.9549 no . 2_565
H46C N32 2.8830 no . 2_565
H46C N41 3.4437 no . 2_565
H46C C33 3.1885 no . 2_565
H46C C34 3.4221 no . 2_565
H46C C35 3.3050 no . 2_565
H46C C36 3.2296 no . 1_455
H46C H36A 2.7886 no . 1_455
H46C H36C 2.8271 no . 1_455
H47A C22 3.4635 no . 2_566
H47A H46B 2.8869 no . 2_565
H47A H56C 3.2434 no . 1_565
H47B C21 3.4102 no . 2_566
H47B C26 3.5959 no . 2_566
H47B C37 3.3220 no . 2_566
H47B H37A 2.9172 no . 2_566
H47B H37C 2.8755 no . 2_566
H47C C21 3.5146 no . 2_566
H47C C23 3.5584 no . 2_566
H47C C24 3.4005 no . 2_566
H47C C25 3.2331 no . 2_566
H47C C26 3.3060 no . 2_566
H47C C57 3.1486 no . 1_465
H47C H57A 3.1581 no . 1_465
H47C H57B 2.4336 no . 1_465
H47C H57C 3.4393 no . 1_465
H54 C34 3.1365 no . 1_545
H54 C36 3.3253 no . 2_655
H54 H34 2.4974 no . 1_545
H54 H36A 2.8431 no . 2_655
H54 H36B 2.9276 no . 2_655
H54 H57C 3.5258 no . 2_655
H56A F23 3.1770 no . 1_554
H56A C56 3.2198 no . 2_555
H56A H36B 3.3781 no . 2_655
H56A H46A 2.7269 no . 2_555
H56A H56A 3.1653 no . 2_555
H56A H56B 2.4946 no . 2_555
H56B F23 3.0516 no . 2_556
H56B C13 3.4906 no . 2_556
H56B C56 3.0048 no . 2_555
H56B H13 2.7522 no . 2_556
H56B H56A 2.4946 no . 2_555
H56B H56B 2.7097 no . 2_555
H56B H56C 3.4314 no . 2_555
H56C C13 3.5740 no . 2_556
H56C C37 3.3904 no . 1_545
H56C C46 3.4176 no . 2_555
H56C H13 3.1800 no . 2_556
H56C H37B 2.5063 no . 1_545
H56C H46A 2.8130 no . 2_555
H56C H46B 3.2600 no . 2_555
H56C H47A 3.2434 no . 1_545
H56C H56B 3.4314 no . 2_555
H57A Au1 3.2806 no . 2_655
H57A N51 2.8632 no . 2_655
H57A N52 3.0574 no . 2_655
H57A C44 3.1605 no . 1_645
H57A C55 3.3933 no . 2_655
H57A H44 2.3009 no . 1_645
H57A H47C 3.1581 no . 1_645
H57B F25 2.7823 no . 2_656
H57B C24 3.0580 no . 2_656
H57B C25 3.0070 no . 2_656
H57B C47 3.3426 no . 1_645
H57B H24 2.9405 no . 2_656
H57B H44 2.9673 no . 1_645
H57B H47C 2.4336 no . 1_645
H57C F25 3.5217 no . 2_656
H57C N51 3.1710 no . 2_655
H57C N52 3.2083 no . 2_655
H57C C24 3.0668 no . 2_656
H57C C53 3.2047 no . 2_655
H57C C54 3.1188 no . 2_655
H57C C55 3.1261 no . 2_655
H57C H24 2.5505 no . 2_656
H57C H47C 3.4393 no . 1_645
H57C H54 3.5258 no . 2_655
C2 H34 3.0823 no . .
C2 H37C 3.1697 no . .
Cl1 H26 3.3258 no . .
Cl1 H37C 3.2092 no . .
Cl2 H34 2.9188 no . .
_chemical_name_systematic        '[PtAu2(dfppy)(Me2pz)3]'
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: dichloromethane/n-hexane'
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_3c
_database_code_depnum_ccdc_archive 'CCDC 1438725'
_audit_update_record             
;
2015-11-25 deposited with the CCDC.
2016-02-22 downloaded from the CCDC.
;
#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C28 H29 Au2 N7 Pt'
_chemical_formula_moiety         'C28 H29 Au2 N7 Pt'
_chemical_formula_weight         1052.61
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_Int_Tables_number      14
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +X,+Y,+Z
2 -X,1/2+Y,1/2-Z
3 -X,-Y,-Z
4 +X,1/2-Y,1/2+Z
#------------------------------------------------------------------------------
_cell_length_a                   10.832(2)
_cell_length_b                   16.340(3)
_cell_length_c                   16.739(3)
_cell_angle_alpha                90.0000
_cell_angle_beta                 105.934(4)
_cell_angle_gamma                90.0000
_cell_volume                     2848.8(9)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    10266
_cell_measurement_theta_min      3.01
_cell_measurement_theta_max      27.49
_cell_measurement_temperature    93
#------------------------------------------------------------------------------
_exptl_crystal_description       prism
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.160
_exptl_crystal_size_mid          0.140
_exptl_crystal_size_min          0.070
_exptl_crystal_density_diffrn    2.454
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1928.00
_exptl_absorpt_coefficient_mu    15.220
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_absorpt_correction_T_min  0.230
_exptl_absorpt_correction_T_max  0.345

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      93
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku Saturn724'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 7.111
_diffrn_reflns_number            23136
_diffrn_reflns_av_R_equivalents  0.0351
_diffrn_reflns_av_sigmaI/netI    0.0404
_diffrn_reflns_theta_max         27.52
_diffrn_reflns_theta_full        27.52
_diffrn_measured_fraction_theta_max 0.986
_diffrn_measured_fraction_theta_full 0.986
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       21
_diffrn_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             6465
_reflns_number_gt                5322
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0206
_refine_ls_wR_factor_ref         0.0436
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         6465
_refine_ls_number_parameters     350
_refine_ls_goodness_of_fit_ref   0.971
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0152P)²+0.0000P] 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_diff_density_max         1.480
_refine_diff_density_min         -1.920
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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 for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.4)
;
Au Au -2.0133 8.8022
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
N N 0.0061 0.0033
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Pt Pt -1.7033 8.3905
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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
Au1 Au 0.109120(15) 0.203017(10) 0.368946(9) 0.01333(4) Uani 1.0 4 d . . .
Au2 Au 0.032845(15) 0.333439(10) 0.239283(9) 0.01390(4) Uani 1.0 4 d . . .
Pt1 Pt 0.290921(15) 0.373497(10) 0.409556(9) 0.01227(4) Uani 1.0 4 d . . .
N1 N 0.2770(4) 0.3655(3) 0.5263(3) 0.0146(10) Uani 0.28(3) 4 d . . .
N10 N 0.2096(4) 0.4836(2) 0.4143(2) 0.0126(9) Uani 0.72(3) 4 d . . .
N21 N 0.3745(4) 0.2606(3) 0.4181(2) 0.0156(8) Uani 1.0 4 d . . .
N22 N 0.2995(3) 0.1919(3) 0.40487(19) 0.0135(8) Uani 1.0 4 d . . .
N31 N 0.2981(4) 0.3939(2) 0.2872(2) 0.0164(8) Uani 1.0 4 d . . .
N32 N 0.1922(4) 0.3808(2) 0.2218(2) 0.0163(8) Uani 1.0 4 d . . .
N41 N -0.0799(4) 0.2199(2) 0.32665(19) 0.0132(8) Uani 1.0 4 d . . .
N42 N -0.1168(4) 0.2778(2) 0.2648(2) 0.0153(8) Uani 1.0 4 d . . .
C2 C 0.3137(4) 0.3043(3) 0.5843(3) 0.0191(10) Uani 1.0 4 d . . .
C3 C 0.2937(5) 0.3116(3) 0.6629(3) 0.0222(11) Uani 1.0 4 d . . .
C4 C 0.2378(4) 0.3802(3) 0.6856(3) 0.0196(10) Uani 1.0 4 d . . .
C5 C 0.1399(4) 0.5193(3) 0.6443(3) 0.0203(10) Uani 1.0 4 d . . .
C6 C 0.1035(4) 0.5785(3) 0.5869(3) 0.0198(10) Uani 1.0 4 d . . .
C7 C 0.0895(5) 0.6283(3) 0.4421(3) 0.0205(10) Uani 1.0 4 d . . .
C8 C 0.1144(5) 0.6139(3) 0.3675(3) 0.0196(10) Uani 1.0 4 d . . .
C9 C 0.1748(4) 0.5420(3) 0.3555(3) 0.0188(10) Uani 1.0 4 d . . .
C11 C 0.1851(4) 0.4990(3) 0.4901(3) 0.0141(9) Uani 1.0 4 d . . .
C12 C 0.2220(4) 0.4358(3) 0.5503(3) 0.0131(9) Uani 1.0 4 d . . .
C13 C 0.2004(4) 0.4443(3) 0.6289(3) 0.0163(10) Uani 1.0 4 d . . .
C14 C 0.1259(4) 0.5704(3) 0.5057(3) 0.0168(10) Uani 1.0 4 d . . .
C10 C 0.2096(4) 0.4836(2) 0.4143(2) 0.0126(9) Uani 0.28(3) 4 d . . .
C1 C 0.2770(4) 0.3655(3) 0.5263(3) 0.0146(10) Uani 0.72(3) 4 d . . .
C23 C 0.3769(5) 0.1249(3) 0.4239(3) 0.0170(10) Uani 1.0 4 d . . .
C24 C 0.5018(5) 0.1526(3) 0.4502(3) 0.0221(11) Uani 1.0 4 d . . .
C25 C 0.4963(4) 0.2377(3) 0.4467(3) 0.0189(10) Uani 1.0 4 d . . .
C26 C 0.3221(5) 0.0401(3) 0.4148(3) 0.0260(12) Uani 1.0 4 d . . .
C27 C 0.6047(5) 0.2967(3) 0.4724(3) 0.0294(12) Uani 1.0 4 d . . .
C33 C 0.2206(5) 0.4014(3) 0.1507(3) 0.0196(10) Uani 1.0 4 d . . .
C34 C 0.3454(5) 0.4294(3) 0.1715(3) 0.0233(11) Uani 1.0 4 d . . .
C35 C 0.3908(5) 0.4243(3) 0.2579(3) 0.0205(10) Uani 1.0 4 d . . .
C36 C 0.1230(5) 0.3934(3) 0.0691(3) 0.0282(12) Uani 1.0 4 d . . .
C37 C 0.5160(5) 0.4516(4) 0.3136(3) 0.0364(14) Uani 1.0 4 d . . .
C43 C -0.2455(5) 0.2795(3) 0.2390(3) 0.0188(10) Uani 1.0 4 d . . .
C44 C -0.2932(5) 0.2228(3) 0.2843(3) 0.0226(11) Uani 1.0 4 d . . .
C45 C -0.1870(5) 0.1864(3) 0.3391(3) 0.0220(11) Uani 1.0 4 d . . .
C46 C -0.3139(5) 0.3381(3) 0.1720(3) 0.0289(12) Uani 1.0 4 d . . .
C47 C -0.1779(5) 0.1215(3) 0.4028(3) 0.0323(13) Uani 1.0 4 d . . .
H2 H 0.3531 0.2563 0.5707 0.0229 Uiso 1.0 4 calc R . .
H3 H 0.3194 0.2682 0.7017 0.0267 Uiso 1.0 4 calc R . .
H4 H 0.2248 0.3840 0.7394 0.0235 Uiso 1.0 4 calc R . .
H5 H 0.1253 0.5271 0.6972 0.0244 Uiso 1.0 4 calc R . .
H6 H 0.0625 0.6262 0.5997 0.0237 Uiso 1.0 4 calc R . .
H7 H 0.0478 0.6773 0.4507 0.0246 Uiso 1.0 4 calc R . .
H8 H 0.0903 0.6531 0.3241 0.0235 Uiso 1.0 4 calc R . .
H9 H 0.1925 0.5335 0.3036 0.0225 Uiso 1.0 4 calc R . .
H24 H 0.5770 0.1200 0.4675 0.0265 Uiso 1.0 4 calc R . .
H26A H 0.2336 0.0416 0.3793 0.0312 Uiso 1.0 4 calc R . .
H26B H 0.3231 0.0187 0.4697 0.0312 Uiso 1.0 4 calc R . .
H26C H 0.3739 0.0046 0.3895 0.0312 Uiso 1.0 4 calc R . .
H27A H 0.5720 0.3499 0.4843 0.0353 Uiso 1.0 4 calc R . .
H27B H 0.6460 0.3027 0.4275 0.0353 Uiso 1.0 4 calc R . .
H27C H 0.6674 0.2763 0.5224 0.0353 Uiso 1.0 4 calc R . .
H34 H 0.3915 0.4485 0.1344 0.0280 Uiso 1.0 4 calc R . .
H36A H 0.0368 0.3965 0.0772 0.0338 Uiso 1.0 4 calc R . .
H36B H 0.1336 0.3405 0.0441 0.0338 Uiso 1.0 4 calc R . .
H36C H 0.1341 0.4377 0.0323 0.0338 Uiso 1.0 4 calc R . .
H37A H 0.5051 0.4658 0.3681 0.0437 Uiso 1.0 4 calc R . .
H37B H 0.5463 0.4997 0.2895 0.0437 Uiso 1.0 4 calc R . .
H37C H 0.5789 0.4073 0.3198 0.0437 Uiso 1.0 4 calc R . .
H44 H -0.3809 0.2110 0.2791 0.0271 Uiso 1.0 4 calc R . .
H46A H -0.2608 0.3483 0.1342 0.0346 Uiso 1.0 4 calc R . .
H46B H -0.3294 0.3898 0.1973 0.0346 Uiso 1.0 4 calc R . .
H46C H -0.3961 0.3143 0.1408 0.0346 Uiso 1.0 4 calc R . .
H47A H -0.1754 0.1468 0.4563 0.0388 Uiso 1.0 4 calc R . .
H47B H -0.0994 0.0895 0.4083 0.0388 Uiso 1.0 4 calc R . .
H47C H -0.2528 0.0854 0.3857 0.0388 Uiso 1.0 4 calc R . .



#==============================================================================
_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
_computing_cell_refinement       CrystalClear
_computing_data_reduction        CrystalClear
_computing_structure_solution    'DIRDIF99-PATTY (Gould, et al., 1999)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_publication_material  'CrystalStructure 4.0 (Rigaku, 2010)'
_computing_molecular_graphics    'CrystalStructure 4.0'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Au1 Au2 2.9917(5) yes . .
Au1 N22 1.991(4) yes . .
Au1 N41 1.994(4) yes . .
Au2 N32 1.985(4) yes . .
Au2 N42 2.004(4) yes . .
Pt1 N1 2.005(4) yes . .
Pt1 N10 2.014(4) yes . .
Pt1 N21 2.042(4) yes . .
Pt1 N31 2.098(4) yes . .
Pt1 C10 2.014(4) yes . .
Pt1 C1 2.005(4) yes . .
N1 C2 1.374(6) yes . .
N1 C12 1.403(6) yes . .
N10 C9 1.347(6) yes . .
N10 C11 1.389(6) yes . .
N21 N22 1.368(5) yes . .
N21 C25 1.328(6) yes . .
N22 C23 1.363(6) yes . .
N31 N32 1.367(5) yes . .
N31 C35 1.329(7) yes . .
N32 C33 1.352(6) yes . .
N41 N42 1.377(5) yes . .
N41 C45 1.349(7) yes . .
N42 C43 1.342(6) yes . .
C2 C3 1.397(7) yes . .
C2 C1 1.374(6) yes . .
C3 C4 1.377(7) yes . .
C4 C13 1.397(6) yes . .
C5 C6 1.343(6) yes . .
C5 C13 1.446(7) yes . .
C6 C14 1.452(7) yes . .
C7 C8 1.368(7) yes . .
C7 C14 1.397(6) yes . .
C8 C9 1.387(7) yes . .
C9 C10 1.347(6) yes . .
C11 C12 1.422(6) yes . .
C11 C14 1.390(6) yes . .
C11 C10 1.389(6) yes . .
C12 C13 1.405(7) yes . .
C12 C1 1.403(6) yes . .
C23 C24 1.379(7) yes . .
C23 C26 1.499(7) yes . .
C24 C25 1.392(7) yes . .
C25 C27 1.489(7) yes . .
C33 C34 1.378(7) yes . .
C33 C36 1.485(6) yes . .
C34 C35 1.396(6) yes . .
C35 C37 1.487(6) yes . .
C43 C44 1.384(7) yes . .
C43 C46 1.506(6) yes . .
C44 C45 1.392(6) yes . .
C45 C47 1.489(7) yes . .
C2 H2 0.950 no . .
C3 H3 0.950 no . .
C4 H4 0.950 no . .
C5 H5 0.950 no . .
C6 H6 0.950 no . .
C7 H7 0.950 no . .
C8 H8 0.950 no . .
C9 H9 0.950 no . .
C24 H24 0.950 no . .
C26 H26A 0.980 no . .
C26 H26B 0.980 no . .
C26 H26C 0.980 no . .
C27 H27A 0.980 no . .
C27 H27B 0.980 no . .
C27 H27C 0.980 no . .
C34 H34 0.950 no . .
C36 H36A 0.980 no . .
C36 H36B 0.980 no . .
C36 H36C 0.980 no . .
C37 H37A 0.980 no . .
C37 H37B 0.980 no . .
C37 H37C 0.980 no . .
C44 H44 0.950 no . .
C46 H46A 0.980 no . .
C46 H46B 0.980 no . .
C46 H46C 0.980 no . .
C47 H47A 0.980 no . .
C47 H47B 0.980 no . .
C47 H47C 0.980 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
Au2 Au1 N22 109.94(11) yes . . .
Au2 Au1 N41 65.90(10) yes . . .
N22 Au1 N41 175.81(14) yes . . .
Au1 Au2 N32 107.85(10) yes . . .
Au1 Au2 N42 66.45(9) yes . . .
N32 Au2 N42 174.28(13) yes . . .
N1 Pt1 N21 91.32(15) yes . . .
N1 Pt1 N31 174.24(15) yes . . .
N1 Pt1 C10 82.52(15) yes . . .
N10 Pt1 N21 173.80(14) yes . . .
N10 Pt1 N31 91.73(14) yes . . .
N10 Pt1 C1 82.52(15) yes . . .
N21 Pt1 N31 94.42(14) yes . . .
N21 Pt1 C10 173.80(14) yes . . .
N21 Pt1 C1 91.32(15) yes . . .
N31 Pt1 C10 91.73(14) yes . . .
N31 Pt1 C1 174.24(15) yes . . .
Pt1 N1 C2 130.7(4) yes . . .
Pt1 N1 C12 112.1(3) yes . . .
C2 N1 C12 117.2(4) yes . . .
Pt1 N10 C9 129.9(3) yes . . .
Pt1 N10 C11 113.1(3) yes . . .
C9 N10 C11 116.9(4) yes . . .
Pt1 N21 N22 119.9(3) yes . . .
Pt1 N21 C25 131.1(3) yes . . .
N22 N21 C25 108.3(4) yes . . .
Au1 N22 N21 119.6(3) yes . . .
Au1 N22 C23 131.6(3) yes . . .
N21 N22 C23 108.7(4) yes . . .
Pt1 N31 N32 120.6(3) yes . . .
Pt1 N31 C35 130.8(3) yes . . .
N32 N31 C35 108.4(4) yes . . .
Au2 N32 N31 121.0(3) yes . . .
Au2 N32 C33 130.1(3) yes . . .
N31 N32 C33 108.8(4) yes . . .
Au1 N41 N42 114.8(3) yes . . .
Au1 N41 C45 137.0(3) yes . . .
N42 N41 C45 108.1(4) yes . . .
Au2 N42 N41 112.8(3) yes . . .
Au2 N42 C43 138.7(3) yes . . .
N41 N42 C43 108.5(4) yes . . .
N1 C2 C3 120.9(5) yes . . .
C3 C2 C1 120.9(5) yes . . .
C2 C3 C4 121.6(4) yes . . .
C3 C4 C13 119.3(5) yes . . .
C6 C5 C13 122.7(5) yes . . .
C5 C6 C14 120.9(5) yes . . .
C8 C7 C14 119.6(5) yes . . .
C7 C8 C9 119.8(4) yes . . .
N10 C9 C8 122.9(5) yes . . .
C8 C9 C10 122.9(5) yes . . .
N10 C11 C12 115.4(4) yes . . .
N10 C11 C14 122.5(4) yes . . .
C12 C11 C14 122.1(4) yes . . .
C12 C11 C10 115.4(4) yes . . .
C14 C11 C10 122.5(4) yes . . .
N1 C12 C11 116.8(4) yes . . .
N1 C12 C13 122.8(4) yes . . .
C11 C12 C13 120.3(4) yes . . .
C11 C12 C1 116.8(4) yes . . .
C13 C12 C1 122.8(4) yes . . .
C4 C13 C5 125.0(5) yes . . .
C4 C13 C12 118.1(4) yes . . .
C5 C13 C12 116.9(4) yes . . .
C6 C14 C7 124.6(4) yes . . .
C6 C14 C11 117.2(4) yes . . .
C7 C14 C11 118.3(5) yes . . .
Pt1 C10 C9 129.9(3) yes . . .
Pt1 C10 C11 113.1(3) yes . . .
C9 C10 C11 116.9(4) yes . . .
Pt1 C1 C2 130.7(4) yes . . .
Pt1 C1 C12 112.1(3) yes . . .
C2 C1 C12 117.2(4) yes . . .
N22 C23 C24 107.3(4) yes . . .
N22 C23 C26 121.2(4) yes . . .
C24 C23 C26 131.5(4) yes . . .
C23 C24 C25 106.7(4) yes . . .
N21 C25 C24 108.9(4) yes . . .
N21 C25 C27 123.2(4) yes . . .
C24 C25 C27 127.8(4) yes . . .
N32 C33 C34 107.7(4) yes . . .
N32 C33 C36 120.7(4) yes . . .
C34 C33 C36 131.6(5) yes . . .
C33 C34 C35 106.5(5) yes . . .
N31 C35 C34 108.5(4) yes . . .
N31 C35 C37 122.1(4) yes . . .
C34 C35 C37 129.2(5) yes . . .
N42 C43 C44 108.7(4) yes . . .
N42 C43 C46 120.6(4) yes . . .
C44 C43 C46 130.8(4) yes . . .
C43 C44 C45 106.4(4) yes . . .
N41 C45 C44 108.4(4) yes . . .
N41 C45 C47 120.6(4) yes . . .
C44 C45 C47 131.1(5) yes . . .
N1 C2 H2 119.519 no . . .
C3 C2 H2 119.535 no . . .
C1 C2 H2 119.519 no . . .
C2 C3 H3 119.203 no . . .
C4 C3 H3 119.229 no . . .
C3 C4 H4 120.327 no . . .
C13 C4 H4 120.331 no . . .
C6 C5 H5 118.656 no . . .
C13 C5 H5 118.653 no . . .
C5 C6 H6 119.574 no . . .
C14 C6 H6 119.558 no . . .
C8 C7 H7 120.207 no . . .
C14 C7 H7 120.208 no . . .
C7 C8 H8 120.105 no . . .
C9 C8 H8 120.100 no . . .
N10 C9 H9 118.551 no . . .
C8 C9 H9 118.557 no . . .
C10 C9 H9 118.551 no . . .
C23 C24 H24 126.647 no . . .
C25 C24 H24 126.661 no . . .
C23 C26 H26A 109.470 no . . .
C23 C26 H26B 109.474 no . . .
C23 C26 H26C 109.473 no . . .
H26A C26 H26B 109.474 no . . .
H26A C26 H26C 109.468 no . . .
H26B C26 H26C 109.468 no . . .
C25 C27 H27A 109.474 no . . .
C25 C27 H27B 109.465 no . . .
C25 C27 H27C 109.471 no . . .
H27A C27 H27B 109.472 no . . .
H27A C27 H27C 109.479 no . . .
H27B C27 H27C 109.467 no . . .
C33 C34 H34 126.741 no . . .
C35 C34 H34 126.750 no . . .
C33 C36 H36A 109.474 no . . .
C33 C36 H36B 109.476 no . . .
C33 C36 H36C 109.467 no . . .
H36A C36 H36B 109.472 no . . .
H36A C36 H36C 109.476 no . . .
H36B C36 H36C 109.463 no . . .
C35 C37 H37A 109.467 no . . .
C35 C37 H37B 109.481 no . . .
C35 C37 H37C 109.467 no . . .
H37A C37 H37B 109.470 no . . .
H37A C37 H37C 109.460 no . . .
H37B C37 H37C 109.482 no . . .
C43 C44 H44 126.811 no . . .
C45 C44 H44 126.815 no . . .
C43 C46 H46A 109.475 no . . .
C43 C46 H46B 109.473 no . . .
C43 C46 H46C 109.459 no . . .
H46A C46 H46B 109.472 no . . .
H46A C46 H46C 109.479 no . . .
H46B C46 H46C 109.469 no . . .
C45 C47 H47A 109.474 no . . .
C45 C47 H47B 109.470 no . . .
C45 C47 H47C 109.469 no . . .
H47A C47 H47B 109.468 no . . .
H47A C47 H47C 109.477 no . . .
H47B C47 H47C 109.471 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
Au2 Au1 N22 N21 42.6(3) no . . . .
Au2 Au1 N22 C23 -140.9(3) no . . . .
N22 Au1 Au2 N32 -1.59(11) no . . . .
N22 Au1 Au2 N42 178.04(11) no . . . .
Au2 Au1 N41 N42 2.16(15) no . . . .
Au2 Au1 N41 C45 177.8(4) no . . . .
N41 Au1 Au2 N32 178.90(11) no . . . .
N41 Au1 Au2 N42 -1.47(11) no . . . .
Au1 Au2 N32 N31 -39.3(3) no . . . .
Au1 Au2 N32 C33 137.3(3) no . . . .
Au1 Au2 N42 N41 2.11(16) no . . . .
Au1 Au2 N42 C43 -177.4(4) no . . . .
N1 Pt1 N10 C9 -178.9(3) no . . . .
N1 Pt1 N10 C11 -0.2(2) no . . . .
N10 Pt1 N1 C2 -179.1(4) no . . . .
N10 Pt1 N1 C12 -0.2(3) no . . . .
N1 Pt1 N21 N22 82.9(3) no . . . .
N1 Pt1 N21 C25 -86.0(4) no . . . .
N21 Pt1 N1 C2 0.2(4) no . . . .
N21 Pt1 N1 C12 179.2(3) no . . . .
N1 Pt1 C10 C9 -178.9(3) no . . . .
N1 Pt1 C10 C11 -0.2(2) no . . . .
C10 Pt1 N1 C2 -179.1(4) no . . . .
C10 Pt1 N1 C12 -0.2(3) no . . . .
N10 Pt1 N31 N32 -81.7(3) no . . . .
N10 Pt1 N31 C35 93.3(3) no . . . .
N31 Pt1 N10 C9 1.4(3) no . . . .
N31 Pt1 N10 C11 -179.8(2) no . . . .
N10 Pt1 C1 C2 -179.1(4) no . . . .
N10 Pt1 C1 C12 -0.2(3) no . . . .
C1 Pt1 N10 C9 -178.9(3) no . . . .
C1 Pt1 N10 C11 -0.2(2) no . . . .
N21 Pt1 N31 N32 99.0(3) no . . . .
N21 Pt1 N31 C35 -86.1(3) no . . . .
N31 Pt1 N21 N22 -97.5(3) no . . . .
N31 Pt1 N21 C25 93.6(3) no . . . .
N21 Pt1 C1 C2 0.2(4) no . . . .
N21 Pt1 C1 C12 179.2(3) no . . . .
C1 Pt1 N21 N22 82.9(3) no . . . .
C1 Pt1 N21 C25 -86.0(4) no . . . .
N31 Pt1 C10 C9 1.4(3) no . . . .
N31 Pt1 C10 C11 -179.8(2) no . . . .
C10 Pt1 N31 N32 -81.7(3) no . . . .
C10 Pt1 N31 C35 93.3(3) no . . . .
C10 Pt1 C1 C2 -179.1(4) no . . . .
C10 Pt1 C1 C12 -0.2(3) no . . . .
C1 Pt1 C10 C9 -178.9(3) no . . . .
C1 Pt1 C10 C11 -0.2(2) no . . . .
Pt1 N1 C2 C3 -179.6(3) no . . . .
Pt1 N1 C12 C11 0.5(4) no . . . .
Pt1 N1 C12 C13 179.1(3) no . . . .
C2 N1 C12 C11 179.6(4) no . . . .
C2 N1 C12 C13 -1.8(6) no . . . .
C12 N1 C2 C3 1.5(6) no . . . .
Pt1 N10 C9 C8 177.2(3) no . . . .
Pt1 N10 C11 C12 0.4(4) no . . . .
Pt1 N10 C11 C14 -178.1(3) no . . . .
C9 N10 C11 C12 179.4(3) no . . . .
C9 N10 C11 C14 0.9(6) no . . . .
C11 N10 C9 C8 -1.5(6) no . . . .
Pt1 N21 N22 Au1 4.7(4) no . . . .
Pt1 N21 N22 C23 -172.64(19) no . . . .
Pt1 N21 C25 C24 171.5(3) no . . . .
Pt1 N21 C25 C27 -6.8(7) no . . . .
N22 N21 C25 C24 1.6(5) no . . . .
N22 N21 C25 C27 -176.6(4) no . . . .
C25 N21 N22 Au1 175.9(3) no . . . .
C25 N21 N22 C23 -1.4(4) no . . . .
Au1 N22 C23 C24 -176.2(3) no . . . .
Au1 N22 C23 C26 3.7(6) no . . . .
N21 N22 C23 C24 0.7(5) no . . . .
N21 N22 C23 C26 -179.4(3) no . . . .
Pt1 N31 N32 Au2 -5.1(4) no . . . .
Pt1 N31 N32 C33 177.54(19) no . . . .
Pt1 N31 C35 C34 -176.8(3) no . . . .
Pt1 N31 C35 C37 -0.3(7) no . . . .
N32 N31 C35 C34 -1.3(5) no . . . .
N32 N31 C35 C37 175.1(4) no . . . .
C35 N31 N32 Au2 178.9(3) no . . . .
C35 N31 N32 C33 1.5(5) no . . . .
Au2 N32 C33 C34 -178.1(3) no . . . .
Au2 N32 C33 C36 2.9(6) no . . . .
N31 N32 C33 C34 -1.1(5) no . . . .
N31 N32 C33 C36 179.9(3) no . . . .
Au1 N41 N42 Au2 -3.2(4) no . . . .
Au1 N41 N42 C43 176.45(19) no . . . .
Au1 N41 C45 C44 -175.4(3) no . . . .
Au1 N41 C45 C47 4.3(7) no . . . .
N42 N41 C45 C44 0.4(5) no . . . .
N42 N41 C45 C47 -179.9(4) no . . . .
C45 N41 N42 Au2 179.9(3) no . . . .
C45 N41 N42 C43 -0.4(4) no . . . .
Au2 N42 C43 C44 179.8(3) no . . . .
Au2 N42 C43 C46 -1.3(7) no . . . .
N41 N42 C43 C44 0.3(5) no . . . .
N41 N42 C43 C46 179.2(3) no . . . .
N1 C2 C3 C4 -0.5(7) no . . . .
C3 C2 C1 Pt1 -179.6(4) no . . . .
C3 C2 C1 C12 1.5(6) no . . . .
C1 C2 C3 C4 -0.5(7) no . . . .
C2 C3 C4 C13 -0.2(7) no . . . .
C3 C4 C13 C5 179.5(4) no . . . .
C3 C4 C13 C12 -0.1(6) no . . . .
C6 C5 C13 C4 -178.7(4) no . . . .
C6 C5 C13 C12 0.9(6) no . . . .
C13 C5 C6 C14 -1.3(7) no . . . .
C5 C6 C14 C7 179.0(4) no . . . .
C5 C6 C14 C11 0.6(6) no . . . .
C8 C7 C14 C6 -179.3(4) no . . . .
C8 C7 C14 C11 -0.9(6) no . . . .
C14 C7 C8 C9 0.3(6) no . . . .
C7 C8 C9 N10 1.0(7) no . . . .
C7 C8 C9 C10 1.0(7) no . . . .
C8 C9 C10 Pt1 177.2(3) no . . . .
C8 C9 C10 C11 -1.5(6) no . . . .
N10 C11 C12 N1 -0.6(5) no . . . .
N10 C11 C12 C13 -179.3(3) no . . . .
N10 C11 C12 C1 -0.6(5) no . . . .
N10 C11 C14 C6 178.8(3) no . . . .
N10 C11 C14 C7 0.3(6) no . . . .
C12 C11 C14 C6 0.4(6) no . . . .
C12 C11 C14 C7 -178.1(4) no . . . .
C14 C11 C12 N1 177.9(4) no . . . .
C14 C11 C12 C13 -0.7(6) no . . . .
C14 C11 C12 C1 177.9(4) no . . . .
C12 C11 C10 Pt1 0.4(5) no . . . .
C12 C11 C10 C9 179.4(3) no . . . .
C10 C11 C12 N1 -0.6(5) no . . . .
C10 C11 C12 C13 -179.3(3) no . . . .
C10 C11 C12 C1 -0.6(5) no . . . .
C14 C11 C10 Pt1 -178.1(3) no . . . .
C14 C11 C10 C9 0.9(6) no . . . .
C10 C11 C14 C6 178.8(3) no . . . .
C10 C11 C14 C7 0.3(6) no . . . .
N1 C12 C13 C4 1.1(6) no . . . .
N1 C12 C13 C5 -178.5(4) no . . . .
C11 C12 C13 C4 179.7(4) no . . . .
C11 C12 C13 C5 0.1(6) no . . . .
C11 C12 C1 Pt1 0.5(5) no . . . .
C11 C12 C1 C2 179.6(3) no . . . .
C13 C12 C1 Pt1 179.1(3) no . . . .
C13 C12 C1 C2 -1.8(6) no . . . .
C1 C12 C13 C4 1.1(6) no . . . .
C1 C12 C13 C5 -178.5(4) no . . . .
N22 C23 C24 C25 0.3(5) no . . . .
C26 C23 C24 C25 -179.6(5) no . . . .
C23 C24 C25 N21 -1.2(5) no . . . .
C23 C24 C25 C27 176.9(4) no . . . .
N32 C33 C34 C35 0.3(5) no . . . .
C36 C33 C34 C35 179.1(5) no . . . .
C33 C34 C35 N31 0.7(5) no . . . .
C33 C34 C35 C37 -175.5(4) no . . . .
N42 C43 C44 C45 -0.0(5) no . . . .
C46 C43 C44 C45 -178.8(4) no . . . .
C43 C44 C45 N41 -0.2(5) no . . . .
C43 C44 C45 C47 -179.9(4) no . . . .

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
Au1 Pt1 3.3712(6) no . .
Au1 C26 3.468(5) no . .
Au1 C47 3.567(6) no . .
Au2 Pt1 3.4630(5) no . .
Au2 C36 3.399(5) no . .
Pt1 C27 3.503(5) no . .
Pt1 C37 3.508(6) no . .
N1 N22 3.536(6) no . .
N1 C4 2.824(7) no . .
N10 N32 3.592(5) no . .
N10 C7 2.799(6) no . .
N21 C2 3.112(6) no . .
N22 C2 3.487(6) no . .
N22 C1 3.536(6) no . .
N31 C9 3.129(6) no . .
N32 C9 3.495(6) no . .
N32 C10 3.592(5) no . .
C2 C13 2.793(7) no . .
C2 C25 3.591(7) no . .
C3 C12 2.734(6) no . .
C4 C1 2.824(7) no . .
C5 C11 2.777(7) no . .
C6 C12 2.809(7) no . .
C7 C10 2.799(6) no . .
C8 C11 2.731(6) no . .
C9 C14 2.747(7) no . .
C13 C14 2.870(6) no . .
N10 C6 3.535(6) no . 3_566
N32 C3 3.558(6) no . 4_554
N42 C6 3.391(6) no . 3_566
N42 C8 3.480(6) no . 2_545
C3 N32 3.558(6) no . 4_555
C3 C33 3.564(7) no . 4_555
C5 C7 3.480(6) no . 3_566
C5 C8 3.474(7) no . 3_566
C5 C9 3.554(7) no . 3_566
C5 C14 3.574(6) no . 3_566
C6 N10 3.535(6) no . 3_566
C6 N42 3.391(6) no . 3_566
C6 C11 3.290(6) no . 3_566
C6 C14 3.518(6) no . 3_566
C6 C10 3.535(6) no . 3_566
C7 C5 3.480(6) no . 3_566
C7 C12 3.568(7) no . 3_566
C7 C13 3.261(6) no . 3_566
C7 C27 3.453(6) no . 3_666
C8 N42 3.480(6) no . 2_555
C8 C5 3.474(7) no . 3_566
C8 C13 3.557(7) no . 3_566
C9 C5 3.554(7) no . 3_566
C11 C6 3.290(6) no . 3_566
C11 C14 3.574(7) no . 3_566
C12 C7 3.568(7) no . 3_566
C13 C7 3.261(6) no . 3_566
C13 C8 3.557(7) no . 3_566
C13 C37 3.411(7) no . 3_666
C14 C5 3.574(6) no . 3_566
C14 C6 3.518(6) no . 3_566
C14 C11 3.574(7) no . 3_566
C14 C14 3.534(6) no . 3_566
C14 C27 3.575(7) no . 3_666
C10 C6 3.535(6) no . 3_566
C26 C46 3.597(7) no . 2_545
C27 C7 3.453(6) no . 3_666
C27 C14 3.575(7) no . 3_666
C33 C3 3.564(7) no . 4_554
C37 C13 3.411(7) no . 3_666
C46 C26 3.597(7) no . 2_555
Au1 H26A 2.9460 no . .
Au1 H47B 3.1300 no . .
Au2 H36A 2.9140 no . .
Au2 H46A 3.1934 no . .
Pt1 H2 3.2243 no . .
Pt1 H9 3.1746 no . .
Pt1 H27A 2.9817 no . .
Pt1 H37A 3.0037 no . .
N1 H3 3.2586 no . .
N1 H27A 3.4646 no . .
N10 H8 3.2480 no . .
N10 H37A 3.5048 no . .
N21 H2 2.6277 no . .
N21 H24 3.1276 no . .
N21 H27A 2.5753 no . .
N21 H27B 2.9818 no . .
N21 H27C 3.1840 no . .
N22 H2 2.8745 no . .
N22 H24 3.1286 no . .
N22 H26A 2.5608 no . .
N22 H26B 3.0168 no . .
N22 H26C 3.1929 no . .
N31 H9 2.6005 no . .
N31 H34 3.1272 no . .
N31 H37A 2.5647 no . .
N31 H37B 3.1875 no . .
N31 H37C 2.9475 no . .
N32 H9 2.8460 no . .
N32 H34 3.1238 no . .
N32 H36A 2.5536 no . .
N32 H36B 2.9400 no . .
N32 H36C 3.1981 no . .
N41 H44 3.1398 no . .
N41 H47A 2.9042 no . .
N41 H47B 2.5718 no . .
N41 H47C 3.2142 no . .
N42 H44 3.1318 no . .
N42 H46A 2.5834 no . .
N42 H46B 2.9160 no . .
N42 H46C 3.2207 no . .
C2 H4 3.2766 no . .
C4 H2 3.2686 no . .
C4 H5 2.7220 no . .
C5 H4 2.7319 no . .
C6 H7 2.7244 no . .
C7 H6 2.7321 no . .
C7 H9 3.2309 no . .
C9 H7 3.2442 no . .
C11 H6 3.2843 no . .
C11 H7 3.2562 no . .
C11 H9 3.1938 no . .
C12 H2 3.2353 no . .
C12 H4 3.2687 no . .
C12 H5 3.2846 no . .
C13 H3 3.2507 no . .
C13 H6 3.3016 no . .
C14 H5 3.2854 no . .
C14 H8 3.2512 no . .
C10 H8 3.2480 no . .
C10 H37A 3.5048 no . .
C1 H3 3.2586 no . .
C1 H27A 3.4646 no . .
C23 H2 3.3257 no . .
C24 H2 3.3630 no . .
C24 H26A 3.3542 no . .
C24 H26B 2.9987 no . .
C24 H26C 2.8339 no . .
C24 H27A 3.3254 no . .
C24 H27B 2.9869 no . .
C24 H27C 2.7510 no . .
C25 H2 2.9268 no . .
C26 H24 2.9614 no . .
C27 H24 2.9015 no . .
C27 H37A 3.2880 no . .
C27 H37C 3.0789 no . .
C33 H9 3.4248 no . .
C34 H9 3.5408 no . .
C34 H36A 3.3250 no . .
C34 H36B 3.0385 no . .
C34 H36C 2.7857 no . .
C34 H37A 3.3246 no . .
C34 H37B 2.7558 no . .
C34 H37C 3.0405 no . .
C35 H9 3.0476 no . .
C36 H34 2.9526 no . .
C37 H27A 3.2156 no . .
C37 H27B 3.1729 no . .
C37 H34 2.9322 no . .
C44 H46A 3.3366 no . .
C44 H46B 3.0670 no . .
C44 H46C 2.7887 no . .
C44 H47A 3.0724 no . .
C44 H47B 3.3267 no . .
C44 H47C 2.7763 no . .
C46 H44 2.9609 no . .
C47 H44 2.9610 no . .
H2 H3 2.3285 no . .
H2 H27A 3.4547 no . .
H3 H4 2.3203 no . .
H4 H5 2.5897 no . .
H5 H6 2.2677 no . .
H6 H7 2.5937 no . .
H7 H8 2.3222 no . .
H8 H9 2.3176 no . .
H9 H37A 3.4425 no . .
H24 H26B 3.2199 no . .
H24 H26C 2.9195 no . .
H24 H27B 3.1922 no . .
H24 H27C 2.7984 no . .
H27A H37A 2.6673 no . .
H27A H37C 2.9286 no . .
H27B H37A 3.0963 no . .
H27B H37C 2.4456 no . .
H34 H36B 3.2979 no . .
H34 H36C 2.8476 no . .
H34 H37B 2.8043 no . .
H34 H37C 3.2787 no . .
H44 H46B 3.3370 no . .
H44 H46C 2.8321 no . .
H44 H47A 3.3512 no . .
H44 H47C 2.8231 no . .
Au1 H4 3.1287 no . 4_554
Au1 H6 3.4724 no . 3_566
Au1 H8 3.4553 no . 2_545
Au1 H36B 2.9576 no . 4_555
Au1 H36C 3.5255 no . 4_555
Au2 H5 3.2030 no . 3_566
Au2 H6 3.2091 no . 3_566
Au2 H8 3.2878 no . 2_545
N10 H6 3.4029 no . 3_566
N21 H3 3.5373 no . 4_554
N22 H3 3.5272 no . 4_554
N22 H4 2.9385 no . 4_554
N22 H36B 3.3528 no . 4_555
N31 H3 3.0480 no . 4_554
N32 H3 2.8615 no . 4_554
N41 H6 2.7849 no . 3_566
N41 H8 2.7232 no . 2_545
N42 H5 3.2574 no . 3_566
N42 H6 2.6874 no . 3_566
N42 H8 2.5851 no . 2_545
C2 H36B 3.0224 no . 4_555
C2 H46C 3.5917 no . 4_655
C3 H36B 3.3540 no . 4_555
C3 H37B 3.5197 no . 3_666
C3 H44 3.5458 no . 4_655
C4 H7 3.4329 no . 3_566
C4 H8 3.5550 no . 3_566
C4 H26A 3.4971 no . 4_555
C4 H37B 2.9927 no . 3_666
C5 H37B 3.2877 no . 3_666
C5 H37C 3.1729 no . 3_666
C5 H46B 3.2339 no . 3_566
C6 H27B 3.3994 no . 3_666
C6 H37C 3.3731 no . 3_666
C7 H27A 3.5508 no . 3_666
C7 H27B 3.2885 no . 3_666
C7 H27C 2.9763 no . 3_666
C8 H5 3.4177 no . 3_566
C8 H27C 3.1323 no . 3_666
C9 H5 3.3239 no . 3_566
C11 H6 3.3792 no . 3_566
C11 H27A 3.5465 no . 3_666
C11 H37A 3.5847 no . 3_666
C12 H6 3.5450 no . 3_566
C12 H7 3.4534 no . 3_566
C12 H37A 3.3130 no . 3_666
C12 H37B 3.3035 no . 3_666
C13 H7 3.3143 no . 3_566
C13 H37A 3.4992 no . 3_666
C13 H37B 2.8590 no . 3_666
C13 H37C 3.3466 no . 3_666
C14 H27A 3.4824 no . 3_666
C14 H27B 3.1845 no . 3_666
C14 H27C 3.4763 no . 3_666
C10 H6 3.4029 no . 3_566
C23 H4 3.0792 no . 4_554
C24 H26B 3.4397 no . 3_656
C24 H44 3.5684 no . 1_655
C24 H46A 3.4270 no . 4_655
C24 H46C 3.1233 no . 4_655
C24 H47A 3.4714 no . 1_655
C24 H47C 3.3192 no . 1_655
C25 H44 3.4476 no . 1_655
C25 H46C 3.2496 no . 4_655
C26 H4 3.0941 no . 4_554
C26 H24 3.2764 no . 3_656
C26 H34 3.5479 no . 4_555
C26 H36C 3.2165 no . 4_555
C26 H46A 3.2605 no . 2_545
C26 H46B 3.1053 no . 2_545
C27 H44 3.5684 no . 1_655
C27 H46A 3.5925 no . 4_655
C27 H46C 3.3547 no . 4_655
C27 H47A 3.4783 no . 1_655
C33 H2 3.3994 no . 4_554
C33 H3 3.0090 no . 4_554
C33 H47B 3.3801 no . 2_555
C33 H47C 3.1050 no . 2_555
C34 H2 3.4848 no . 4_554
C34 H3 3.2922 no . 4_554
C34 H26B 3.4265 no . 4_554
C34 H46B 3.4898 no . 1_655
C34 H46C 3.5254 no . 1_655
C34 H47C 2.8087 no . 2_555
C35 H3 3.3127 no . 4_554
C35 H46B 3.4952 no . 1_655
C36 H2 3.4875 no . 4_554
C36 H26B 3.3936 no . 4_554
C36 H47A 3.3304 no . 4_554
C36 H47B 3.2449 no . 2_555
C36 H47B 3.0930 no . 4_554
C36 H47C 3.4363 no . 2_555
C37 H46B 3.0661 no . 1_655
C43 H5 3.4730 no . 3_566
C43 H6 3.2659 no . 3_566
C43 H8 3.0300 no . 2_545
C43 H37C 3.3500 no . 1_455
C44 H8 3.4068 no . 2_545
C44 H27B 2.9577 no . 1_455
C44 H37C 3.4377 no . 1_455
C45 H6 3.3902 no . 3_566
C45 H8 3.2283 no . 2_545
C45 H9 3.4454 no . 2_545
C45 H27B 3.2467 no . 1_455
C46 H5 3.3708 no . 3_566
C46 H24 3.3709 no . 4_454
C46 H26A 3.5995 no . 2_555
C46 H26C 2.9179 no . 2_555
C46 H27C 3.0867 no . 4_454
C46 H34 3.5677 no . 1_455
C46 H37C 3.2135 no . 1_455
C47 H24 3.1301 no . 1_455
C47 H34 3.5974 no . 2_545
C47 H36A 3.2076 no . 4_555
C47 H36C 3.1843 no . 2_545
H2 C33 3.3994 no . 4_555
H2 C34 3.4848 no . 4_555
H2 C36 3.4875 no . 4_555
H2 H34 3.5016 no . 4_555
H2 H36B 2.7885 no . 4_555
H2 H46C 2.8874 no . 4_655
H3 N21 3.5373 no . 4_555
H3 N22 3.5272 no . 4_555
H3 N31 3.0480 no . 4_555
H3 N32 2.8615 no . 4_555
H3 C33 3.0090 no . 4_555
H3 C34 3.2922 no . 4_555
H3 C35 3.3127 no . 4_555
H3 H36B 3.3535 no . 4_555
H3 H44 3.1661 no . 4_655
H4 Au1 3.1287 no . 4_555
H4 N22 2.9385 no . 4_555
H4 C23 3.0792 no . 4_555
H4 C26 3.0941 no . 4_555
H4 H8 3.3401 no . 3_566
H4 H26A 2.6180 no . 4_555
H4 H26C 3.1636 no . 4_555
H4 H37B 3.2633 no . 3_666
H5 Au2 3.2030 no . 3_566
H5 N42 3.2574 no . 3_566
H5 C8 3.4177 no . 3_566
H5 C9 3.3239 no . 3_566
H5 C43 3.4730 no . 3_566
H5 C46 3.3708 no . 3_566
H5 H9 3.5783 no . 3_566
H5 H26A 3.1562 no . 4_555
H5 H37B 3.5295 no . 3_666
H5 H37C 3.4630 no . 3_666
H5 H46A 3.4622 no . 3_566
H5 H46B 2.7756 no . 3_566
H6 Au1 3.4724 no . 3_566
H6 Au2 3.2091 no . 3_566
H6 N10 3.4029 no . 3_566
H6 N41 2.7849 no . 3_566
H6 N42 2.6874 no . 3_566
H6 C11 3.3792 no . 3_566
H6 C12 3.5450 no . 3_566
H6 C10 3.4029 no . 3_566
H6 C43 3.2659 no . 3_566
H6 C45 3.3902 no . 3_566
H6 H27B 3.5099 no . 3_666
H7 C4 3.4329 no . 3_566
H7 C12 3.4534 no . 3_566
H7 C13 3.3143 no . 3_566
H7 H27B 3.4000 no . 3_666
H7 H27C 3.0876 no . 3_666
H7 H36B 3.3274 no . 2_555
H7 H47A 3.3783 no . 3_566
H8 Au1 3.4553 no . 2_555
H8 Au2 3.2878 no . 2_555
H8 N41 2.7232 no . 2_555
H8 N42 2.5851 no . 2_555
H8 C4 3.5550 no . 3_566
H8 C43 3.0300 no . 2_555
H8 C44 3.4068 no . 2_555
H8 C45 3.2283 no . 2_555
H8 H4 3.3401 no . 3_566
H8 H27C 3.3351 no . 3_666
H9 C45 3.4454 no . 2_555
H9 H5 3.5783 no . 3_566
H9 H47B 3.5321 no . 2_555
H9 H47C 3.5109 no . 2_555
H24 C26 3.2764 no . 3_656
H24 C46 3.3709 no . 4_655
H24 C47 3.1301 no . 1_655
H24 H26B 2.6047 no . 3_656
H24 H26C 3.0753 no . 3_656
H24 H34 3.3459 no . 2_645
H24 H46A 2.9067 no . 4_655
H24 H46C 3.0325 no . 4_655
H24 H47A 2.7738 no . 1_655
H24 H47C 2.6409 no . 1_655
H26A C4 3.4971 no . 4_554
H26A C46 3.5995 no . 2_545
H26A H4 2.6180 no . 4_554
H26A H5 3.1562 no . 4_554
H26A H36C 3.0572 no . 4_555
H26A H46A 3.1845 no . 2_545
H26A H46B 3.0993 no . 2_545
H26B C24 3.4397 no . 3_656
H26B C34 3.4265 no . 4_555
H26B C36 3.3936 no . 4_555
H26B H24 2.6047 no . 3_656
H26B H26C 3.4967 no . 3_656
H26B H34 2.7046 no . 4_555
H26B H36B 3.5301 no . 4_555
H26B H36C 2.6412 no . 4_555
H26B H46A 3.2522 no . 2_545
H26B H46B 3.5155 no . 2_545
H26B H47A 3.5347 no . 3_556
H26B H47C 3.2154 no . 3_556
H26C C46 2.9179 no . 2_545
H26C H4 3.1636 no . 4_554
H26C H24 3.0753 no . 3_656
H26C H26B 3.4967 no . 3_656
H26C H34 2.8320 no . 2_645
H26C H37B 3.3400 no . 2_645
H26C H46A 2.8124 no . 2_545
H26C H46B 2.3409 no . 2_545
H26C H46C 3.1699 no . 2_545
H27A C7 3.5508 no . 3_666
H27A C11 3.5465 no . 3_666
H27A C14 3.4824 no . 3_666
H27B C6 3.3994 no . 3_666
H27B C7 3.2885 no . 3_666
H27B C14 3.1845 no . 3_666
H27B C44 2.9577 no . 1_655
H27B C45 3.2467 no . 1_655
H27B H6 3.5099 no . 3_666
H27B H7 3.4000 no . 3_666
H27B H44 2.8460 no . 1_655
H27B H47A 3.1543 no . 1_655
H27C C7 2.9763 no . 3_666
H27C C8 3.1323 no . 3_666
H27C C14 3.4763 no . 3_666
H27C C46 3.0867 no . 4_655
H27C H7 3.0876 no . 3_666
H27C H8 3.3351 no . 3_666
H27C H46A 2.7304 no . 4_655
H27C H46C 2.7107 no . 4_655
H27C H47A 3.1038 no . 1_655
H34 C26 3.5479 no . 4_554
H34 C46 3.5677 no . 1_655
H34 C47 3.5974 no . 2_555
H34 H2 3.5016 no . 4_554
H34 H24 3.3459 no . 2_655
H34 H26B 2.7046 no . 4_554
H34 H26C 2.8320 no . 2_655
H34 H46B 3.0695 no . 1_655
H34 H46C 3.1579 no . 1_655
H34 H47C 2.6641 no . 2_555
H36A C47 3.2076 no . 4_554
H36A H36C 3.5013 no . 3_565
H36A H47A 2.7069 no . 4_554
H36A H47B 3.2202 no . 2_555
H36A H47B 2.8158 no . 4_554
H36B Au1 2.9576 no . 4_554
H36B N22 3.3528 no . 4_554
H36B C2 3.0224 no . 4_554
H36B C3 3.3540 no . 4_554
H36B H2 2.7885 no . 4_554
H36B H3 3.3535 no . 4_554
H36B H7 3.3274 no . 2_545
H36B H26B 3.5301 no . 4_554
H36B H47A 3.2720 no . 4_554
H36B H47B 3.1139 no . 4_554
H36C Au1 3.5255 no . 4_554
H36C C26 3.2165 no . 4_554
H36C C47 3.1843 no . 2_555
H36C H26A 3.0572 no . 4_554
H36C H26B 2.6412 no . 4_554
H36C H36A 3.5013 no . 3_565
H36C H36C 3.4675 no . 3_565
H36C H47A 3.4445 no . 2_555
H36C H47A 3.5240 no . 4_554
H36C H47B 2.7358 no . 2_555
H36C H47B 2.8314 no . 4_554
H36C H47C 2.8966 no . 2_555
H37A C11 3.5847 no . 3_666
H37A C12 3.3130 no . 3_666
H37A C13 3.4992 no . 3_666
H37B C3 3.5197 no . 3_666
H37B C4 2.9927 no . 3_666
H37B C5 3.2877 no . 3_666
H37B C12 3.3035 no . 3_666
H37B C13 2.8590 no . 3_666
H37B H4 3.2633 no . 3_666
H37B H5 3.5295 no . 3_666
H37B H26C 3.3400 no . 2_655
H37B H46B 2.9253 no . 1_655
H37C C5 3.1729 no . 3_666
H37C C6 3.3731 no . 3_666
H37C C13 3.3466 no . 3_666
H37C C43 3.3500 no . 1_655
H37C C44 3.4377 no . 1_655
H37C C46 3.2135 no . 1_655
H37C H5 3.4630 no . 3_666
H37C H44 3.3326 no . 1_655
H37C H46B 2.5276 no . 1_655
H37C H46C 3.4352 no . 1_655
H44 C3 3.5458 no . 4_454
H44 C24 3.5684 no . 1_455
H44 C25 3.4476 no . 1_455
H44 C27 3.5684 no . 1_455
H44 H3 3.1661 no . 4_454
H44 H27B 2.8460 no . 1_455
H44 H37C 3.3326 no . 1_455
H46A C24 3.4270 no . 4_454
H46A C26 3.2605 no . 2_555
H46A C27 3.5925 no . 4_454
H46A H5 3.4622 no . 3_566
H46A H24 2.9067 no . 4_454
H46A H26A 3.1845 no . 2_555
H46A H26B 3.2522 no . 2_555
H46A H26C 2.8124 no . 2_555
H46A H27C 2.7304 no . 4_454
H46A H47A 3.3526 no . 4_554
H46B C5 3.2339 no . 3_566
H46B C26 3.1053 no . 2_555
H46B C34 3.4898 no . 1_455
H46B C35 3.4952 no . 1_455
H46B C37 3.0661 no . 1_455
H46B H5 2.7756 no . 3_566
H46B H26A 3.0993 no . 2_555
H46B H26B 3.5155 no . 2_555
H46B H26C 2.3409 no . 2_555
H46B H34 3.0695 no . 1_455
H46B H37B 2.9253 no . 1_455
H46B H37C 2.5276 no . 1_455
H46C C2 3.5917 no . 4_454
H46C C24 3.1233 no . 4_454
H46C C25 3.2496 no . 4_454
H46C C27 3.3547 no . 4_454
H46C C34 3.5254 no . 1_455
H46C H2 2.8874 no . 4_454
H46C H24 3.0325 no . 4_454
H46C H26C 3.1699 no . 2_555
H46C H27C 2.7107 no . 4_454
H46C H34 3.1579 no . 1_455
H46C H37C 3.4352 no . 1_455
H47A C24 3.4714 no . 1_455
H47A C27 3.4783 no . 1_455
H47A C36 3.3304 no . 4_555
H47A H7 3.3783 no . 3_566
H47A H24 2.7738 no . 1_455
H47A H26B 3.5347 no . 3_556
H47A H27B 3.1543 no . 1_455
H47A H27C 3.1038 no . 1_455
H47A H36A 2.7069 no . 4_555
H47A H36B 3.2720 no . 4_555
H47A H36C 3.4445 no . 2_545
H47A H36C 3.5240 no . 4_555
H47A H46A 3.3526 no . 4_555
H47B C33 3.3801 no . 2_545
H47B C36 3.2449 no . 2_545
H47B C36 3.0930 no . 4_555
H47B H9 3.5321 no . 2_545
H47B H36A 3.2202 no . 2_545
H47B H36A 2.8158 no . 4_555
H47B H36B 3.1139 no . 4_555
H47B H36C 2.7358 no . 2_545
H47B H36C 2.8314 no . 4_555
H47C C24 3.3192 no . 1_455
H47C C33 3.1050 no . 2_545
H47C C34 2.8087 no . 2_545
H47C C36 3.4363 no . 2_545
H47C H9 3.5109 no . 2_545
H47C H24 2.6409 no . 1_455
H47C H26B 3.2154 no . 3_556
H47C H34 2.6641 no . 2_545
H47C H36C 2.8966 no . 2_545
_chemical_name_systematic        '[PtAu2(bzq)(Me2pz)3]'
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_4d
_database_code_depnum_ccdc_archive 'CCDC 1438726'
_audit_update_record             
;
2015-11-25 deposited with the CCDC.
2016-02-22 downloaded from the CCDC.
;
#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C43 H50 Ag2 F12 N12 O P2 Pt2'
_chemical_formula_moiety         'C40 H44 Ag2 N12 Pt2, 2(P F6), C3 H6 O'
_chemical_formula_weight         1646.79
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_space_group_crystal_system      monoclinic
_space_group_name_H-M_alt        'P 1 21/n 1'
_space_group_name_Hall           '-P 2yn'
_space_group_IT_number           14
loop_
_symmetry_equiv_pos_site_id
_space_group_symop_operation_xyz
1 +X,+Y,+Z
2 1/2-X,1/2+Y,1/2-Z
3 -X,-Y,-Z
4 1/2+X,1/2-Y,1/2+Z
#------------------------------------------------------------------------------
_cell_length_a                   13.979(2)
_cell_length_b                   17.286(3)
_cell_length_c                   21.804(3)
_cell_angle_alpha                90.0000
_cell_angle_beta                 94.440(3)
_cell_angle_gamma                90.0000
_cell_volume                     5252.9(13)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    14941
_cell_measurement_theta_min      3.01
_cell_measurement_theta_max      27.49
_cell_measurement_temperature    93
#------------------------------------------------------------------------------
_exptl_crystal_description       prism
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.130
_exptl_crystal_size_mid          0.030
_exptl_crystal_size_min          0.020
_exptl_crystal_density_diffrn    2.082
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3152.00
_exptl_absorpt_coefficient_mu    6.171
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_absorpt_correction_T_min  0.749
_exptl_absorpt_correction_T_max  0.884

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      93
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku Saturn724'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 7.111
_diffrn_reflns_number            43379
_diffrn_reflns_av_R_equivalents  0.0422
_diffrn_reflns_av_sigmaI/netI    0.0451
_diffrn_reflns_theta_max         27.490
_diffrn_reflns_theta_min         3.011
_diffrn_reflns_theta_full        27.490
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measured_fraction_theta_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.000
_diffrn_reflns_Laue_measured_fraction_full 0.000
_diffrn_reflns_point_group_measured_fraction_max 0.000
_diffrn_reflns_point_group_measured_fraction_full 0.000
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       23
_diffrn_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             12021
_reflns_number_gt                10265
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_all          0.0512
_refine_ls_R_factor_gt           0.0416
_refine_ls_wR_factor_ref         0.0793
_refine_ls_wR_factor_gt          0.0748
_refine_ls_number_restraints     36
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         12021
_refine_ls_number_parameters     677
_refine_ls_goodness_of_fit_ref   1.104
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0226P)²+22.4050P] 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          0.011
_refine_diff_density_max         1.92
_refine_diff_density_min         -0.87
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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 for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(Vol. C, Table 6.1.1.4)
;
Ag Ag -0.8971 1.1015
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
F F 0.0171 0.0103
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
N N 0.0061 0.0033
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
P P 0.1023 0.0942
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Pt Pt -1.7033 8.3905
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
O O 0.0106 0.0060
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.600585(14) 0.269310(12) 0.543394(9) 0.01464(6) Uani 1 4 d . . .
Pt2 Pt 0.955764(15) 0.223414(13) 0.602523(9) 0.01633(6) Uani 1 4 d . . .
Ag1 Ag 0.80768(3) 0.37649(2) 0.54761(2) 0.02068(10) Uani 1 4 d . . .
Ag2 Ag 0.76447(3) 0.29692(2) 0.672411(19) 0.01750(9) Uani 1 4 d . . .
P1 P 0.85314(11) 0.30818(9) 0.88753(7) 0.0193(3) Uani 1 4 d . . .
P2 P 1.22722(11) 0.04967(9) 0.70243(7) 0.0230(3) Uani 1 4 d . . .
F1 F 0.7697(2) 0.24890(19) 0.90027(15) 0.0244(7) Uani 1 4 d . . .
F2 F 0.7771(3) 0.3751(2) 0.87193(18) 0.0345(9) Uani 1 4 d . . .
F3 F 0.9297(3) 0.2400(3) 0.9010(2) 0.0518(11) Uani 1 4 d . . .
F4 F 0.9375(3) 0.3675(2) 0.87486(18) 0.0323(8) Uani 1 4 d . . .
F5 F 0.8456(3) 0.2841(2) 0.81675(18) 0.0395(10) Uani 1 4 d . . .
F6 F 0.8629(3) 0.3331(3) 0.95777(19) 0.0520(11) Uani 1 4 d . . .
F7 F 1.2535(3) 0.1372(2) 0.7213(2) 0.0458(11) Uani 1 4 d . . .
F8 F 1.2069(3) -0.0377(2) 0.68327(19) 0.0448(11) Uani 1 4 d . . .
F9 F 1.2555(3) 0.0222(3) 0.77112(18) 0.0466(11) Uani 1 4 d . . .
F10 F 1.2030(3) 0.0769(3) 0.63346(18) 0.0498(12) Uani 1 4 d . . .
F11 F 1.3364(3) 0.0372(2) 0.6863(2) 0.0434(10) Uani 1 4 d . . .
F12 F 1.1213(3) 0.0629(3) 0.7196(2) 0.0579(13) Uani 1 4 d . . .
O1 O 0.4751(4) 0.6376(3) 0.1499(2) 0.0454(13) Uani 1 4 d . . .
N11 N 0.6130(3) 0.1570(3) 0.5212(2) 0.0212(10) Uani 1 4 d . . .
N21 N 0.6313(3) 0.2813(3) 0.4551(2) 0.0173(10) Uani 1 4 d . . .
N31 N 0.5931(3) 0.3827(3) 0.5618(2) 0.0152(9) Uani 1 4 d . . .
N32 N 0.6774(3) 0.4240(3) 0.5680(2) 0.0189(10) Uani 1 4 d . . .
N41 N 0.5630(3) 0.2443(3) 0.6278(2) 0.0170(10) Uani 1 4 d . . .
N42 N 0.6326(3) 0.2406(3) 0.6760(2) 0.0194(10) Uani 1 4 d . . .
N51 N 0.9245(3) 0.1515(3) 0.6708(2) 0.0167(9) Uani 1 4 d . . .
N61 N 0.9242(3) 0.1270(3) 0.5525(2) 0.0188(10) Uani 1 4 d . . .
N71 N 0.9919(3) 0.2879(3) 0.5313(2) 0.0211(10) Uani 1 4 d . . .
N72 N 0.9333(3) 0.3469(3) 0.5090(2) 0.0214(10) Uani 1 4 d . . .
N81 N 0.9776(3) 0.3160(3) 0.6567(2) 0.0178(10) Uani 1 4 d . . .
N82 N 0.8991(3) 0.3507(3) 0.6791(2) 0.0172(10) Uani 1 4 d . . .
C1 C 0.5414(6) 0.6290(4) 0.2531(3) 0.0406(17) Uani 1 4 d . . .
C2 C 0.5354(5) 0.6595(4) 0.1883(3) 0.0328(15) Uani 1 4 d . . .
C3 C 0.6108(5) 0.7166(4) 0.1737(4) 0.0414(18) Uani 1 4 d . . .
C12 C 0.6255(4) 0.1437(3) 0.4608(3) 0.0196(12) Uani 1 4 d . . .
C13 C 0.6339(4) 0.0690(4) 0.4387(3) 0.0285(14) Uani 1 4 d . . .
C14 C 0.6297(5) 0.0077(4) 0.4793(4) 0.0342(16) Uani 1 4 d . . .
C15 C 0.6180(4) 0.0217(4) 0.5403(3) 0.0296(15) Uani 1 4 d . . .
C16 C 0.6100(4) 0.0972(3) 0.5603(3) 0.0241(13) Uani 1 4 d . . .
C22 C 0.6326(4) 0.2135(4) 0.4231(3) 0.0209(12) Uani 1 4 d . . .
C23 C 0.6408(4) 0.2134(4) 0.3606(3) 0.0267(14) Uani 1 4 d . . .
C24 C 0.6489(5) 0.2824(4) 0.3296(3) 0.0338(16) Uani 1 4 d . . .
C25 C 0.6490(4) 0.3506(4) 0.3619(3) 0.0278(14) Uani 1 4 d . . .
C26 C 0.6397(4) 0.3483(3) 0.4247(3) 0.0215(12) Uani 1 4 d . . .
C33 C 0.6553(4) 0.4979(3) 0.5800(3) 0.0216(12) Uani 1 4 d . . .
C34 C 0.5567(4) 0.5039(3) 0.5827(3) 0.0249(13) Uani 1 4 d . . .
C35 C 0.5200(4) 0.4304(3) 0.5704(3) 0.0198(12) Uani 1 4 d . . .
C36 C 0.7309(5) 0.5577(3) 0.5869(3) 0.0300(15) Uani 1 4 d . . .
C37 C 0.4179(4) 0.4029(4) 0.5666(3) 0.0281(14) Uani 1 4 d . . .
C43 C 0.5952(4) 0.2015(3) 0.7219(3) 0.0208(12) Uani 1 4 d . . .
C44 C 0.5023(4) 0.1790(3) 0.7030(3) 0.0204(12) Uani 1 4 d . . .
C45 C 0.4837(4) 0.2068(3) 0.6435(3) 0.0174(11) Uani 1 4 d . . .
C46 C 0.6498(4) 0.1904(4) 0.7825(3) 0.0268(14) Uani 1 4 d . . .
C47 C 0.3952(4) 0.2005(4) 0.6027(3) 0.0248(13) Uani 1 4 d . . .
C52 C 0.8983(4) 0.0783(3) 0.6521(3) 0.0176(11) Uani 1 4 d . . .
C53 C 0.8762(4) 0.0228(4) 0.6943(3) 0.0225(12) Uani 1 4 d . . .
C54 C 0.8831(4) 0.0409(4) 0.7561(3) 0.0224(12) Uani 1 4 d . . .
C55 C 0.9100(4) 0.1151(3) 0.7744(3) 0.0211(12) Uani 1 4 d . . .
C56 C 0.9304(4) 0.1696(3) 0.7308(2) 0.0189(12) Uani 1 4 d . . .
C62 C 0.8961(4) 0.0653(3) 0.5849(3) 0.0190(12) Uani 1 4 d . . .
C63 C 0.8687(4) -0.0035(4) 0.5570(3) 0.0234(13) Uani 1 4 d . . .
C64 C 0.8676(4) -0.0083(4) 0.4932(3) 0.0257(13) Uani 1 4 d . . .
C65 C 0.8952(4) 0.0544(4) 0.4597(3) 0.0268(14) Uani 1 4 d . . .
C66 C 0.9231(4) 0.1215(4) 0.4906(3) 0.0220(12) Uani 1 4 d . . .
C73 C 0.9739(5) 0.3776(4) 0.4606(3) 0.0298(14) Uani 1 4 d . . .
C74 C 1.0581(4) 0.3376(4) 0.4524(3) 0.0268(14) Uani 1 4 d . . .
C75 C 1.0674(4) 0.2819(4) 0.4975(3) 0.0226(13) Uani 1 4 d . . .
C76 C 0.9288(6) 0.4438(5) 0.4253(4) 0.046(2) Uani 1 4 d . . .
C77 C 1.1432(5) 0.2221(4) 0.5103(3) 0.0312(15) Uani 1 4 d . . .
C83 C 0.9313(4) 0.4130(3) 0.7120(3) 0.0211(12) Uani 1 4 d . . .
C84 C 1.0297(4) 0.4180(4) 0.7103(3) 0.0238(13) Uani 1 4 d . . .
C85 C 1.0565(4) 0.3567(4) 0.6749(3) 0.0235(13) Uani 1 4 d . . .
C86 C 0.8638(5) 0.4631(4) 0.7440(3) 0.0283(14) Uani 1 4 d . . .
C87 C 1.1544(4) 0.3342(4) 0.6569(3) 0.0355(16) Uani 1 4 d . . .
H1A H 0.55404 0.57328 0.25267 0.0487 Uiso 1 4 calc R . .
H1B H 0.48054 0.63866 0.27124 0.0487 Uiso 1 4 calc R . .
H1C H 0.5935 0.65529 0.27752 0.0487 Uiso 1 4 calc R . .
H3A H 0.58611 0.74948 0.13938 0.0497 Uiso 1 4 calc R . .
H3B H 0.66788 0.6889 0.16211 0.0497 Uiso 1 4 calc R . .
H3C H 0.62778 0.74884 0.20984 0.0497 Uiso 1 4 calc R . .
H13 H 0.64232 0.06008 0.39648 0.0342 Uiso 1 4 calc R . .
H14 H 0.63479 -0.04392 0.46499 0.0411 Uiso 1 4 calc R . .
H15 H 0.61555 -0.02005 0.5685 0.0355 Uiso 1 4 calc R . .
H16 H 0.6023 0.10696 0.60245 0.0289 Uiso 1 4 calc R . .
H23 H 0.64085 0.16584 0.33875 0.0321 Uiso 1 4 calc R . .
H24 H 0.65427 0.2828 0.28646 0.0405 Uiso 1 4 calc R . .
H25 H 0.65533 0.39865 0.3415 0.0333 Uiso 1 4 calc R . .
H26 H 0.6393 0.39557 0.44699 0.0258 Uiso 1 4 calc R . .
H34 H 0.52144 0.54918 0.59119 0.0299 Uiso 1 4 calc R . .
H36A H 0.76026 0.56404 0.54787 0.0359 Uiso 1 4 calc R . .
H36B H 0.77999 0.54187 0.61899 0.0359 Uiso 1 4 calc R . .
H36C H 0.70248 0.6069 0.59856 0.0359 Uiso 1 4 calc R . .
H37A H 0.40778 0.36538 0.53302 0.0338 Uiso 1 4 calc R . .
H37B H 0.37478 0.44712 0.55864 0.0338 Uiso 1 4 calc R . .
H37C H 0.40454 0.37842 0.60549 0.0338 Uiso 1 4 calc R . .
H44 H 0.45979 0.15011 0.7261 0.0245 Uiso 1 4 calc R . .
H46A H 0.64521 0.23732 0.80732 0.0321 Uiso 1 4 calc R . .
H46B H 0.71722 0.17997 0.77623 0.0321 Uiso 1 4 calc R . .
H46C H 0.62284 0.14656 0.8039 0.0321 Uiso 1 4 calc R . .
H47A H 0.41032 0.2083 0.55996 0.0298 Uiso 1 4 calc R . .
H47B H 0.34937 0.23999 0.61384 0.0298 Uiso 1 4 calc R . .
H47C H 0.36716 0.14905 0.60701 0.0298 Uiso 1 4 calc R . .
H53 H 0.85646 -0.02739 0.68091 0.0270 Uiso 1 4 calc R . .
H54 H 0.86945 0.00299 0.78577 0.0269 Uiso 1 4 calc R . .
H55 H 0.91455 0.12851 0.81682 0.0254 Uiso 1 4 calc R . .
H56 H 0.94869 0.22043 0.74347 0.0226 Uiso 1 4 calc R . .
H63 H 0.85104 -0.04664 0.58063 0.0280 Uiso 1 4 calc R . .
H64 H 0.84771 -0.05479 0.47272 0.0308 Uiso 1 4 calc R . .
H65 H 0.89502 0.05149 0.41618 0.0321 Uiso 1 4 calc R . .
H66 H 0.94211 0.16492 0.46775 0.0264 Uiso 1 4 calc R . .
H74 H 1.101 0.34691 0.42146 0.0322 Uiso 1 4 calc R . .
H76A H 0.89922 0.47894 0.45362 0.0553 Uiso 1 4 calc R . .
H76B H 0.87963 0.42431 0.39473 0.0553 Uiso 1 4 calc R . .
H76C H 0.97799 0.47169 0.40444 0.0553 Uiso 1 4 calc R . .
H77A H 1.20634 0.24706 0.51422 0.0375 Uiso 1 4 calc R . .
H77B H 1.14079 0.18471 0.47649 0.0375 Uiso 1 4 calc R . .
H77C H 1.13228 0.19529 0.54878 0.0375 Uiso 1 4 calc R . .
H84 H 1.07072 0.456 0.72967 0.0285 Uiso 1 4 calc R . .
H86A H 0.83184 0.43211 0.77403 0.0339 Uiso 1 4 calc R . .
H86B H 0.81563 0.48475 0.71374 0.0339 Uiso 1 4 calc R . .
H86C H 0.89969 0.50521 0.76521 0.0339 Uiso 1 4 calc R . .
H87A H 1.16483 0.27884 0.66467 0.0426 Uiso 1 4 calc R . .
H87B H 1.20336 0.36407 0.68123 0.0426 Uiso 1 4 calc R . .
H87C H 1.15894 0.34489 0.61308 0.0426 Uiso 1 4 calc R . .



#==============================================================================
_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
_computing_cell_refinement       CrystalClear
_computing_data_reduction        CrystalClear
_computing_structure_solution    'Il Milione (Burla, et al., 2007)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_publication_material  'CrystalStructure 4.1 (Rigaku, 2014)'
_computing_molecular_graphics    'CrystalStructure 4.1'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Pt1 N11 2.013(5) yes . .
Pt1 N21 2.016(5) yes . .
Pt1 N31 2.005(4) yes . .
Pt1 N41 2.000(5) yes . .
Pt2 N51 2.014(5) yes . .
Pt2 N61 2.021(5) yes . .
Pt2 N71 2.007(5) yes . .
Pt2 N81 1.999(5) yes . .
Ag1 N32 2.078(5) yes . .
Ag1 N72 2.070(5) yes . .
Ag2 N42 2.092(5) yes . .
Ag2 N82 2.094(4) yes . .
P1 F1 1.593(4) yes . .
P1 F2 1.590(4) yes . .
P1 F3 1.604(5) yes . .
P1 F4 1.603(4) yes . .
P1 F5 1.594(4) yes . .
P1 F6 1.586(4) yes . .
P2 F7 1.602(4) yes . .
P2 F8 1.587(4) yes . .
P2 F9 1.591(4) yes . .
P2 F10 1.587(4) yes . .
P2 F11 1.607(4) yes . .
P2 F12 1.571(4) yes . .
O1 C2 1.203(8) yes . .
N11 C12 1.360(8) yes . .
N11 C16 1.342(8) yes . .
N21 C22 1.365(8) yes . .
N21 C26 1.343(7) yes . .
N31 N32 1.375(6) yes . .
N31 C35 1.338(7) yes . .
N32 C33 1.344(7) yes . .
N41 N42 1.377(6) yes . .
N41 C45 1.351(7) yes . .
N42 C43 1.346(8) yes . .
N51 C52 1.370(7) yes . .
N51 C56 1.341(7) yes . .
N61 C62 1.355(7) yes . .
N61 C66 1.352(7) yes . .
N71 N72 1.373(7) yes . .
N71 C75 1.338(8) yes . .
N72 C73 1.345(8) yes . .
N81 N82 1.373(6) yes . .
N81 C85 1.342(7) yes . .
N82 C83 1.351(7) yes . .
C1 C2 1.503(10) yes . .
C2 C3 1.496(10) yes . .
C12 C13 1.386(9) yes . .
C12 C22 1.467(8) yes . .
C13 C14 1.385(10) yes . .
C14 C15 1.374(10) yes . .
C15 C16 1.383(9) yes . .
C22 C23 1.378(9) yes . .
C23 C24 1.380(10) yes . .
C24 C25 1.372(10) yes . .
C25 C26 1.386(9) yes . .
C33 C34 1.389(9) yes . .
C33 C36 1.478(9) yes . .
C34 C35 1.389(8) yes . .
C35 C37 1.500(8) yes . .
C43 C44 1.388(8) yes . .
C43 C46 1.486(8) yes . .
C44 C45 1.388(8) yes . .
C45 C47 1.471(8) yes . .
C52 C53 1.381(8) yes . .
C52 C62 1.479(8) yes . .
C53 C54 1.380(8) yes . .
C54 C55 1.387(8) yes . .
C55 C56 1.384(8) yes . .
C62 C63 1.377(8) yes . .
C63 C64 1.392(8) yes . .
C64 C65 1.378(9) yes . .
C65 C66 1.384(9) yes . .
C73 C74 1.387(9) yes . .
C73 C76 1.492(10) yes . .
C74 C75 1.375(9) yes . .
C75 C77 1.491(9) yes . .
C83 C84 1.382(8) yes . .
C83 C86 1.493(9) yes . .
C84 C85 1.380(9) yes . .
C85 C87 1.504(9) yes . .
C1 H1A 0.980 no . .
C1 H1B 0.980 no . .
C1 H1C 0.980 no . .
C3 H3A 0.980 no . .
C3 H3B 0.980 no . .
C3 H3C 0.980 no . .
C13 H13 0.950 no . .
C14 H14 0.950 no . .
C15 H15 0.950 no . .
C16 H16 0.950 no . .
C23 H23 0.950 no . .
C24 H24 0.950 no . .
C25 H25 0.950 no . .
C26 H26 0.950 no . .
C34 H34 0.950 no . .
C36 H36A 0.980 no . .
C36 H36B 0.980 no . .
C36 H36C 0.980 no . .
C37 H37A 0.980 no . .
C37 H37B 0.980 no . .
C37 H37C 0.980 no . .
C44 H44 0.950 no . .
C46 H46A 0.980 no . .
C46 H46B 0.980 no . .
C46 H46C 0.980 no . .
C47 H47A 0.980 no . .
C47 H47B 0.980 no . .
C47 H47C 0.980 no . .
C53 H53 0.950 no . .
C54 H54 0.950 no . .
C55 H55 0.950 no . .
C56 H56 0.950 no . .
C63 H63 0.950 no . .
C64 H64 0.950 no . .
C65 H65 0.950 no . .
C66 H66 0.950 no . .
C74 H74 0.950 no . .
C76 H76A 0.980 no . .
C76 H76B 0.980 no . .
C76 H76C 0.980 no . .
C77 H77A 0.980 no . .
C77 H77B 0.980 no . .
C77 H77C 0.980 no . .
C84 H84 0.950 no . .
C86 H86A 0.980 no . .
C86 H86B 0.980 no . .
C86 H86C 0.980 no . .
C87 H87A 0.980 no . .
C87 H87B 0.980 no . .
C87 H87C 0.980 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
N11 Pt1 N21 80.8(2) yes . . .
N11 Pt1 N31 176.78(19) yes . . .
N11 Pt1 N41 92.7(2) yes . . .
N21 Pt1 N31 96.26(18) yes . . .
N21 Pt1 N41 172.71(18) yes . . .
N31 Pt1 N41 90.30(18) yes . . .
N51 Pt2 N61 80.73(19) yes . . .
N51 Pt2 N71 175.42(19) yes . . .
N51 Pt2 N81 95.10(19) yes . . .
N61 Pt2 N71 95.64(19) yes . . .
N61 Pt2 N81 174.84(19) yes . . .
N71 Pt2 N81 88.67(19) yes . . .
N32 Ag1 N72 166.00(18) yes . . .
N42 Ag2 N82 173.70(18) yes . . .
F1 P1 F2 91.05(19) yes . . .
F1 P1 F3 89.0(2) yes . . .
F1 P1 F4 179.7(2) yes . . .
F1 P1 F5 90.4(2) yes . . .
F1 P1 F6 90.9(2) yes . . .
F2 P1 F3 178.2(3) yes . . .
F2 P1 F4 89.3(2) yes . . .
F2 P1 F5 89.4(2) yes . . .
F2 P1 F6 90.9(2) yes . . .
F3 P1 F4 90.7(2) yes . . .
F3 P1 F5 88.8(2) yes . . .
F3 P1 F6 90.9(3) yes . . .
F4 P1 F5 89.7(2) yes . . .
F4 P1 F6 89.1(2) yes . . .
F5 P1 F6 178.7(3) yes . . .
F7 P2 F8 177.0(3) yes . . .
F7 P2 F9 90.3(2) yes . . .
F7 P2 F10 89.5(2) yes . . .
F7 P2 F11 88.9(2) yes . . .
F7 P2 F12 90.1(3) yes . . .
F8 P2 F9 89.4(2) yes . . .
F8 P2 F10 90.7(2) yes . . .
F8 P2 F11 88.2(2) yes . . .
F8 P2 F12 92.8(3) yes . . .
F9 P2 F10 178.0(3) yes . . .
F9 P2 F11 89.7(2) yes . . .
F9 P2 F12 89.4(3) yes . . .
F10 P2 F11 88.3(2) yes . . .
F10 P2 F12 92.7(3) yes . . .
F11 P2 F12 178.6(3) yes . . .
Pt1 N11 C12 114.5(4) yes . . .
Pt1 N11 C16 125.6(4) yes . . .
C12 N11 C16 119.8(5) yes . . .
Pt1 N21 C22 114.3(4) yes . . .
Pt1 N21 C26 126.3(4) yes . . .
C22 N21 C26 119.0(5) yes . . .
Pt1 N31 N32 118.0(3) yes . . .
Pt1 N31 C35 133.0(4) yes . . .
N32 N31 C35 108.9(4) yes . . .
Ag1 N32 N31 122.2(3) yes . . .
Ag1 N32 C33 129.5(4) yes . . .
N31 N32 C33 107.7(4) yes . . .
Pt1 N41 N42 119.5(3) yes . . .
Pt1 N41 C45 128.0(4) yes . . .
N42 N41 C45 109.2(4) yes . . .
Ag2 N42 N41 121.5(4) yes . . .
Ag2 N42 C43 130.9(4) yes . . .
N41 N42 C43 107.4(4) yes . . .
Pt2 N51 C52 114.7(4) yes . . .
Pt2 N51 C56 125.2(4) yes . . .
C52 N51 C56 120.1(5) yes . . .
Pt2 N61 C62 115.4(4) yes . . .
Pt2 N61 C66 125.6(4) yes . . .
C62 N61 C66 118.9(5) yes . . .
Pt2 N71 N72 120.6(4) yes . . .
Pt2 N71 C75 129.8(4) yes . . .
N72 N71 C75 109.6(5) yes . . .
Ag1 N72 N71 122.7(4) yes . . .
Ag1 N72 C73 130.2(4) yes . . .
N71 N72 C73 107.2(5) yes . . .
Pt2 N81 N82 118.1(3) yes . . .
Pt2 N81 C85 132.7(4) yes . . .
N82 N81 C85 109.1(5) yes . . .
Ag2 N82 N81 121.3(3) yes . . .
Ag2 N82 C83 130.7(4) yes . . .
N81 N82 C83 107.1(4) yes . . .
O1 C2 C1 121.9(6) yes . . .
O1 C2 C3 121.7(7) yes . . .
C1 C2 C3 116.3(6) yes . . .
N11 C12 C13 120.9(5) yes . . .
N11 C12 C22 115.0(5) yes . . .
C13 C12 C22 124.1(6) yes . . .
C12 C13 C14 118.8(6) yes . . .
C13 C14 C15 119.9(6) yes . . .
C14 C15 C16 119.3(6) yes . . .
N11 C16 C15 121.3(6) yes . . .
N21 C22 C12 114.6(5) yes . . .
N21 C22 C23 120.8(6) yes . . .
C12 C22 C23 124.6(6) yes . . .
C22 C23 C24 119.9(6) yes . . .
C23 C24 C25 119.2(6) yes . . .
C24 C25 C26 119.1(6) yes . . .
N21 C26 C25 121.9(6) yes . . .
N32 C33 C34 108.9(5) yes . . .
N32 C33 C36 120.8(5) yes . . .
C34 C33 C36 130.3(5) yes . . .
C33 C34 C35 106.0(5) yes . . .
N31 C35 C34 108.4(5) yes . . .
N31 C35 C37 122.1(5) yes . . .
C34 C35 C37 129.4(5) yes . . .
N42 C43 C44 109.1(5) yes . . .
N42 C43 C46 121.6(5) yes . . .
C44 C43 C46 129.3(5) yes . . .
C43 C44 C45 106.5(5) yes . . .
N41 C45 C44 107.8(5) yes . . .
N41 C45 C47 123.3(5) yes . . .
C44 C45 C47 128.9(5) yes . . .
N51 C52 C53 120.7(5) yes . . .
N51 C52 C62 114.9(5) yes . . .
C53 C52 C62 124.5(5) yes . . .
C52 C53 C54 119.5(5) yes . . .
C53 C54 C55 119.2(5) yes . . .
C54 C55 C56 119.8(5) yes . . .
N51 C56 C55 120.7(5) yes . . .
N61 C62 C52 114.3(5) yes . . .
N61 C62 C63 122.1(5) yes . . .
C52 C62 C63 123.6(5) yes . . .
C62 C63 C64 118.3(6) yes . . .
C63 C64 C65 120.0(6) yes . . .
C64 C65 C66 118.8(6) yes . . .
N61 C66 C65 121.8(6) yes . . .
N72 C73 C74 108.6(5) yes . . .
N72 C73 C76 121.3(6) yes . . .
C74 C73 C76 130.1(6) yes . . .
C73 C74 C75 106.9(6) yes . . .
N71 C75 C74 107.8(5) yes . . .
N71 C75 C77 122.0(5) yes . . .
C74 C75 C77 130.3(6) yes . . .
N82 C83 C84 109.1(5) yes . . .
N82 C83 C86 120.9(5) yes . . .
C84 C83 C86 130.0(5) yes . . .
C83 C84 C85 106.3(5) yes . . .
N81 C85 C84 108.3(5) yes . . .
N81 C85 C87 122.1(5) yes . . .
C84 C85 C87 129.6(6) yes . . .
C2 C1 H1A 109.479 no . . .
C2 C1 H1B 109.474 no . . .
C2 C1 H1C 109.472 no . . .
H1A C1 H1B 109.462 no . . .
H1A C1 H1C 109.469 no . . .
H1B C1 H1C 109.471 no . . .
C2 C3 H3A 109.474 no . . .
C2 C3 H3B 109.476 no . . .
C2 C3 H3C 109.464 no . . .
H3A C3 H3B 109.468 no . . .
H3A C3 H3C 109.475 no . . .
H3B C3 H3C 109.471 no . . .
C12 C13 H13 120.600 no . . .
C14 C13 H13 120.609 no . . .
C13 C14 H14 120.057 no . . .
C15 C14 H14 120.066 no . . .
C14 C15 H15 120.371 no . . .
C16 C15 H15 120.372 no . . .
N11 C16 H16 119.337 no . . .
C15 C16 H16 119.346 no . . .
C22 C23 H23 120.026 no . . .
C24 C23 H23 120.025 no . . .
C23 C24 H24 120.386 no . . .
C25 C24 H24 120.375 no . . .
C24 C25 H25 120.446 no . . .
C26 C25 H25 120.445 no . . .
N21 C26 H26 119.033 no . . .
C25 C26 H26 119.035 no . . .
C33 C34 H34 127.010 no . . .
C35 C34 H34 127.015 no . . .
C33 C36 H36A 109.467 no . . .
C33 C36 H36B 109.473 no . . .
C33 C36 H36C 109.475 no . . .
H36A C36 H36B 109.467 no . . .
H36A C36 H36C 109.466 no . . .
H36B C36 H36C 109.479 no . . .
C35 C37 H37A 109.467 no . . .
C35 C37 H37B 109.475 no . . .
C35 C37 H37C 109.467 no . . .
H37A C37 H37B 109.476 no . . .
H37A C37 H37C 109.469 no . . .
H37B C37 H37C 109.472 no . . .
C43 C44 H44 126.740 no . . .
C45 C44 H44 126.744 no . . .
C43 C46 H46A 109.474 no . . .
C43 C46 H46B 109.460 no . . .
C43 C46 H46C 109.478 no . . .
H46A C46 H46B 109.470 no . . .
H46A C46 H46C 109.475 no . . .
H46B C46 H46C 109.470 no . . .
C45 C47 H47A 109.468 no . . .
C45 C47 H47B 109.469 no . . .
C45 C47 H47C 109.466 no . . .
H47A C47 H47B 109.478 no . . .
H47A C47 H47C 109.472 no . . .
H47B C47 H47C 109.473 no . . .
C52 C53 H53 120.257 no . . .
C54 C53 H53 120.253 no . . .
C53 C54 H54 120.422 no . . .
C55 C54 H54 120.409 no . . .
C54 C55 H55 120.098 no . . .
C56 C55 H55 120.085 no . . .
N51 C56 H56 119.649 no . . .
C55 C56 H56 119.633 no . . .
C62 C63 H63 120.820 no . . .
C64 C63 H63 120.838 no . . .
C63 C64 H64 119.981 no . . .
C65 C64 H64 119.977 no . . .
C64 C65 H65 120.614 no . . .
C66 C65 H65 120.597 no . . .
N61 C66 H66 119.110 no . . .
C65 C66 H66 119.129 no . . .
C73 C74 H74 126.562 no . . .
C75 C74 H74 126.559 no . . .
C73 C76 H76A 109.475 no . . .
C73 C76 H76B 109.466 no . . .
C73 C76 H76C 109.461 no . . .
H76A C76 H76B 109.482 no . . .
H76A C76 H76C 109.470 no . . .
H76B C76 H76C 109.473 no . . .
C75 C77 H77A 109.471 no . . .
C75 C77 H77B 109.465 no . . .
C75 C77 H77C 109.474 no . . .
H77A C77 H77B 109.470 no . . .
H77A C77 H77C 109.477 no . . .
H77B C77 H77C 109.470 no . . .
C83 C84 H84 126.834 no . . .
C85 C84 H84 126.831 no . . .
C83 C86 H86A 109.478 no . . .
C83 C86 H86B 109.467 no . . .
C83 C86 H86C 109.469 no . . .
H86A C86 H86B 109.469 no . . .
H86A C86 H86C 109.482 no . . .
H86B C86 H86C 109.463 no . . .
C85 C87 H87A 109.468 no . . .
C85 C87 H87B 109.465 no . . .
C85 C87 H87C 109.475 no . . .
H87A C87 H87B 109.462 no . . .
H87A C87 H87C 109.487 no . . .
H87B C87 H87C 109.469 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
N11 Pt1 N21 C22 7.9(3) no . . . .
N11 Pt1 N21 C26 -179.7(4) no . . . .
N21 Pt1 N11 C12 -5.8(3) no . . . .
N21 Pt1 N11 C16 174.1(4) no . . . .
N11 Pt1 N41 N42 93.1(3) no . . . .
N11 Pt1 N41 C45 -64.2(4) no . . . .
N41 Pt1 N11 C12 170.8(3) no . . . .
N41 Pt1 N11 C16 -9.3(3) no . . . .
N21 Pt1 N31 N32 -73.0(3) no . . . .
N21 Pt1 N31 C35 107.3(4) no . . . .
N31 Pt1 N21 C22 -173.5(3) no . . . .
N31 Pt1 N21 C26 -1.1(4) no . . . .
N31 Pt1 N41 N42 -85.7(3) no . . . .
N31 Pt1 N41 C45 117.0(4) no . . . .
N41 Pt1 N31 N32 110.2(3) no . . . .
N41 Pt1 N31 C35 -69.5(4) no . . . .
N51 Pt2 N61 C62 2.0(3) no . . . .
N51 Pt2 N61 C66 177.5(4) no . . . .
N61 Pt2 N51 C52 -0.5(3) no . . . .
N61 Pt2 N51 C56 177.5(4) no . . . .
N51 Pt2 N81 N82 -72.8(3) no . . . .
N51 Pt2 N81 C85 111.3(4) no . . . .
N81 Pt2 N51 C52 176.4(3) no . . . .
N81 Pt2 N51 C56 -5.6(3) no . . . .
N61 Pt2 N71 N72 108.5(3) no . . . .
N61 Pt2 N71 C75 -68.9(4) no . . . .
N71 Pt2 N61 C62 179.2(3) no . . . .
N71 Pt2 N61 C66 -5.3(4) no . . . .
N71 Pt2 N81 N82 109.8(3) no . . . .
N71 Pt2 N81 C85 -66.0(4) no . . . .
N81 Pt2 N71 N72 -68.7(3) no . . . .
N81 Pt2 N71 C75 114.0(4) no . . . .
Pt1 N11 C12 C13 -179.1(3) no . . . .
Pt1 N11 C12 C22 2.9(5) no . . . .
Pt1 N11 C16 C15 179.1(3) no . . . .
C12 N11 C16 C15 -1.0(7) no . . . .
C16 N11 C12 C13 1.0(7) no . . . .
C16 N11 C12 C22 -177.0(4) no . . . .
Pt1 N21 C22 C12 -8.5(5) no . . . .
Pt1 N21 C22 C23 171.9(3) no . . . .
Pt1 N21 C26 C25 -171.6(3) no . . . .
C22 N21 C26 C25 0.5(7) no . . . .
C26 N21 C22 C12 178.5(4) no . . . .
C26 N21 C22 C23 -1.1(7) no . . . .
Pt1 N31 N32 Ag1 8.1(5) no . . . .
Pt1 N31 N32 C33 179.9(2) no . . . .
Pt1 N31 C35 C34 179.3(3) no . . . .
Pt1 N31 C35 C37 -0.5(8) no . . . .
N32 N31 C35 C34 -0.4(5) no . . . .
N32 N31 C35 C37 179.8(4) no . . . .
C35 N31 N32 Ag1 -172.1(4) no . . . .
C35 N31 N32 C33 -0.4(5) no . . . .
Ag1 N32 C33 C34 171.9(3) no . . . .
Ag1 N32 C33 C36 -7.0(7) no . . . .
N31 N32 C33 C34 1.0(6) no . . . .
N31 N32 C33 C36 -177.9(4) no . . . .
Pt1 N41 N42 Ag2 22.3(5) no . . . .
Pt1 N41 N42 C43 -162.1(3) no . . . .
Pt1 N41 C45 C44 159.5(3) no . . . .
Pt1 N41 C45 C47 -21.5(7) no . . . .
N42 N41 C45 C44 0.3(6) no . . . .
N42 N41 C45 C47 179.3(4) no . . . .
C45 N41 N42 Ag2 -176.5(4) no . . . .
C45 N41 N42 C43 -0.8(5) no . . . .
Ag2 N42 C43 C44 176.1(3) no . . . .
Ag2 N42 C43 C46 -1.6(8) no . . . .
N41 N42 C43 C44 1.0(6) no . . . .
N41 N42 C43 C46 -176.7(4) no . . . .
Pt2 N51 C52 C53 179.1(3) no . . . .
Pt2 N51 C52 C62 -0.9(5) no . . . .
Pt2 N51 C56 C55 -178.0(3) no . . . .
C52 N51 C56 C55 -0.1(7) no . . . .
C56 N51 C52 C53 1.0(7) no . . . .
C56 N51 C52 C62 -179.1(4) no . . . .
Pt2 N61 C62 C52 -3.0(5) no . . . .
Pt2 N61 C62 C63 177.5(3) no . . . .
Pt2 N61 C66 C65 -176.1(3) no . . . .
C62 N61 C66 C65 -0.7(7) no . . . .
C66 N61 C62 C52 -178.9(4) no . . . .
C66 N61 C62 C63 1.7(7) no . . . .
Pt2 N71 N72 Ag1 2.2(6) no . . . .
Pt2 N71 N72 C73 -177.9(3) no . . . .
Pt2 N71 C75 C74 177.5(3) no . . . .
Pt2 N71 C75 C77 -1.7(8) no . . . .
N72 N71 C75 C74 -0.1(6) no . . . .
N72 N71 C75 C77 -179.3(4) no . . . .
C75 N71 N72 Ag1 180.0(4) no . . . .
C75 N71 N72 C73 -0.1(5) no . . . .
Ag1 N72 C73 C74 -179.8(3) no . . . .
Ag1 N72 C73 C76 0.2(8) no . . . .
N71 N72 C73 C74 0.2(6) no . . . .
N71 N72 C73 C76 -179.7(4) no . . . .
Pt2 N81 N82 Ag2 12.3(5) no . . . .
Pt2 N81 N82 C83 -177.5(2) no . . . .
Pt2 N81 C85 C84 177.1(3) no . . . .
Pt2 N81 C85 C87 -2.9(8) no . . . .
N82 N81 C85 C84 1.0(6) no . . . .
N82 N81 C85 C87 -179.0(4) no . . . .
C85 N81 N82 Ag2 -170.9(4) no . . . .
C85 N81 N82 C83 -0.7(5) no . . . .
Ag2 N82 C83 C84 169.1(3) no . . . .
Ag2 N82 C83 C86 -9.7(7) no . . . .
N81 N82 C83 C84 0.2(6) no . . . .
N81 N82 C83 C86 -178.7(4) no . . . .
N11 C12 C13 C14 -0.3(8) no . . . .
N11 C12 C22 N21 3.7(6) no . . . .
N11 C12 C22 C23 -176.8(4) no . . . .
C13 C12 C22 N21 -174.1(5) no . . . .
C13 C12 C22 C23 5.4(8) no . . . .
C22 C12 C13 C14 177.5(4) no . . . .
C12 C13 C14 C15 -0.4(8) no . . . .
C13 C14 C15 C16 0.4(9) no . . . .
C14 C15 C16 N11 0.3(9) no . . . .
N21 C22 C23 C24 0.7(8) no . . . .
C12 C22 C23 C24 -178.8(4) no . . . .
C22 C23 C24 C25 0.2(9) no . . . .
C23 C24 C25 C26 -0.8(9) no . . . .
C24 C25 C26 N21 0.5(8) no . . . .
N32 C33 C34 C35 -1.2(6) no . . . .
C36 C33 C34 C35 177.5(5) no . . . .
C33 C34 C35 N31 1.0(6) no . . . .
C33 C34 C35 C37 -179.3(5) no . . . .
N42 C43 C44 C45 -0.8(6) no . . . .
C46 C43 C44 C45 176.7(5) no . . . .
C43 C44 C45 N41 0.3(6) no . . . .
C43 C44 C45 C47 -178.7(5) no . . . .
N51 C52 C53 C54 -1.7(8) no . . . .
N51 C52 C62 N61 2.6(7) no . . . .
N51 C52 C62 C63 -177.9(4) no . . . .
C53 C52 C62 N61 -177.5(5) no . . . .
C53 C52 C62 C63 2.0(8) no . . . .
C62 C52 C53 C54 178.4(4) no . . . .
C52 C53 C54 C55 1.4(8) no . . . .
C53 C54 C55 C56 -0.5(8) no . . . .
C54 C55 C56 N51 -0.2(8) no . . . .
N61 C62 C63 C64 -1.9(8) no . . . .
C52 C62 C63 C64 178.7(4) no . . . .
C62 C63 C64 C65 1.3(8) no . . . .
C63 C64 C65 C66 -0.4(8) no . . . .
C64 C65 C66 N61 0.2(8) no . . . .
N72 C73 C74 C75 -0.3(7) no . . . .
C76 C73 C74 C75 179.6(6) no . . . .
C73 C74 C75 N71 0.2(6) no . . . .
C73 C74 C75 C77 179.3(5) no . . . .
N82 C83 C84 C85 0.4(6) no . . . .
C86 C83 C84 C85 179.1(5) no . . . .
C83 C84 C85 N81 -0.8(6) no . . . .
C83 C84 C85 C87 179.2(5) no . . . .

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
Pt1 Ag1 3.4323(6) no . .
Pt1 Ag2 3.5202(6) no . .
Pt1 C37 3.509(6) no . .
Pt1 C47 3.449(6) no . .
Pt2 Ag1 3.5124(5) no . .
Pt2 Ag2 3.4232(6) no . .
Pt2 C77 3.423(7) no . .
Pt2 C87 3.503(6) no . .
Ag1 Ag2 3.1490(7) no . .
Ag1 N21 3.476(4) no . .
Ag1 N81 3.395(4) no . .
Ag1 N82 3.081(4) no . .
Ag1 C26 3.457(6) no . .
Ag1 C36 3.441(6) no . .
Ag1 C76 3.469(8) no . .
Ag2 N31 3.585(4) no . .
Ag2 N32 3.327(4) no . .
Ag2 N51 3.368(5) no . .
Ag2 C46 3.510(6) no . .
Ag2 C56 3.374(6) no . .
Ag2 C86 3.504(6) no . .
N11 C14 2.752(8) no . .
N11 C45 3.447(8) no . .
N21 N32 3.509(6) no . .
N21 C24 2.765(8) no . .
N31 N42 3.511(6) no . .
N31 C26 3.165(7) no . .
N32 C26 3.389(7) no . .
N41 C16 3.036(8) no . .
N41 C35 3.487(7) no . .
N42 C16 3.534(8) no . .
N51 N82 3.469(6) no . .
N51 C54 2.759(8) no . .
N61 C64 2.760(8) no . .
N71 C66 3.139(8) no . .
N71 C85 3.404(7) no . .
N71 C87 3.512(8) no . .
N72 N81 3.278(7) no . .
N81 C56 3.100(7) no . .
N82 C56 3.344(7) no . .
C12 C15 2.737(9) no . .
C13 C16 2.740(10) no . .
C13 C23 3.027(9) no . .
C14 C64 3.327(8) no . .
C15 C63 3.522(8) no . .
C16 C45 3.242(8) no . .
C22 C25 2.738(9) no . .
C23 C26 2.721(9) no . .
C52 C55 2.736(8) no . .
C53 C56 2.748(8) no . .
C53 C63 3.023(8) no . .
C62 C65 2.736(8) no . .
C63 C66 2.741(9) no . .
C66 C75 3.425(9) no . .
C66 C77 3.531(9) no . .
Ag2 F5 3.269(4) no . .
F1 C36 3.317(7) no . 2_646
F1 C46 3.124(7) no . .
F1 C74 3.577(7) no . 4_455
F1 C77 3.130(7) no . 4_455
F2 O1 3.528(6) no . 3_666
F2 C15 3.435(7) no . 2_656
F2 C53 3.567(7) no . 2_656
F2 C63 3.384(7) no . 2_656
F2 C86 3.477(8) no . .
F3 N21 2.992(6) no . 4_555
F3 C12 3.561(7) no . 4_555
F3 C22 2.952(7) no . 4_555
F3 C23 3.246(8) no . 4_555
F3 C24 3.564(8) no . 4_555
F3 C26 3.314(7) no . 4_555
F3 C55 3.498(7) no . .
F4 C12 3.113(6) no . 4_555
F4 C13 3.175(7) no . 4_555
F4 C15 3.370(7) no . 2_656
F4 C22 3.171(6) no . 4_555
F4 C23 3.203(7) no . 4_555
F4 C86 3.388(7) no . .
F5 Ag2 3.269(4) no . .
F5 N82 3.352(6) no . .
F5 C46 3.218(7) no . .
F5 C55 3.214(7) no . .
F5 C56 3.030(7) no . .
F5 C83 3.470(7) no . .
F5 C86 3.494(7) no . .
F6 C14 3.314(8) no . 2_656
F6 C15 3.272(8) no . 2_656
F6 C47 3.210(7) no . 4_555
F6 C77 3.493(8) no . 4_455
F7 C24 3.192(8) no . 4_555
F7 C25 3.504(8) no . 4_555
F7 C47 3.551(7) no . 1_655
F8 C1 3.272(9) no . 4_555
F8 C2 3.199(8) no . 4_555
F8 C3 3.371(8) no . 4_555
F8 C65 3.339(7) no . 3_756
F9 C25 3.380(8) no . 4_555
F9 C84 3.499(7) no . 2_746
F10 C47 3.539(8) no . 1_655
F10 C64 3.095(7) no . 3_756
F10 C65 3.275(7) no . 3_756
F11 C13 3.339(8) no . 3_756
F11 C44 3.374(7) no . 1_655
F11 C47 3.494(8) no . 1_655
F11 C84 3.489(7) no . 2_746
F12 N51 3.254(6) no . .
F12 C1 3.594(9) no . 4_555
F12 C24 3.592(9) no . 4_555
F12 C25 3.439(8) no . 4_555
F12 C52 3.354(6) no . .
F12 C53 3.497(7) no . .
F12 C54 3.505(7) no . .
F12 C55 3.393(7) no . .
F12 C56 3.269(7) no . .
O1 F2 3.528(6) no . 3_666
O1 C53 3.278(8) no . 4_454
O1 C63 3.350(8) no . 4_454
O1 C65 3.426(8) no . 2_655
O1 C66 3.488(8) no . 2_655
N21 F3 2.992(6) no . 4_454
N51 F12 3.254(6) no . .
N82 F5 3.352(6) no . .
C1 F8 3.272(9) no . 4_454
C1 F12 3.594(9) no . 4_454
C1 C43 3.562(9) no . 3_666
C1 C44 3.521(9) no . 3_666
C2 F8 3.199(8) no . 4_454
C3 F8 3.371(8) no . 4_454
C3 C24 3.553(10) no . 2_655
C12 F3 3.561(7) no . 4_454
C12 F4 3.113(6) no . 4_454
C13 F4 3.175(7) no . 4_454
C13 F11 3.339(8) no . 3_756
C14 F6 3.314(8) no . 2_646
C14 C15 3.493(9) no . 3_656
C15 F2 3.435(7) no . 2_646
C15 F4 3.370(7) no . 2_646
C15 F6 3.272(8) no . 2_646
C15 C14 3.493(9) no . 3_656
C22 F3 2.952(7) no . 4_454
C22 F4 3.171(6) no . 4_454
C23 F3 3.246(8) no . 4_454
C23 F4 3.203(7) no . 4_454
C24 F3 3.564(8) no . 4_454
C24 F7 3.192(8) no . 4_454
C24 F12 3.592(9) no . 4_454
C24 C3 3.553(10) no . 2_645
C25 F7 3.504(8) no . 4_454
C25 F9 3.380(8) no . 4_454
C25 F12 3.439(8) no . 4_454
C26 F3 3.314(7) no . 4_454
C36 F1 3.317(7) no . 2_656
C43 C1 3.562(9) no . 3_666
C44 F11 3.374(7) no . 1_455
C44 C1 3.521(9) no . 3_666
C46 F1 3.124(7) no . .
C46 F5 3.218(7) no . .
C47 F6 3.210(7) no . 4_454
C47 F7 3.551(7) no . 1_455
C47 F10 3.539(8) no . 1_455
C47 F11 3.494(8) no . 1_455
C52 F12 3.354(6) no . .
C53 F2 3.567(7) no . 2_646
C53 F12 3.497(7) no . .
C53 O1 3.278(8) no . 4_555
C54 F12 3.505(7) no . .
C55 F3 3.498(7) no . .
C55 F5 3.214(7) no . .
C55 F12 3.393(7) no . .
C56 F5 3.030(7) no . .
C56 F12 3.269(7) no . .
C63 F2 3.384(7) no . 2_646
C63 O1 3.350(8) no . 4_555
C63 C65 3.462(8) no . 3_756
C64 F10 3.095(7) no . 3_756
C64 C65 3.488(8) no . 3_756
C64 C66 3.515(8) no . 3_756
C65 F8 3.339(7) no . 3_756
C65 F10 3.275(7) no . 3_756
C65 O1 3.426(8) no . 2_645
C65 C63 3.462(8) no . 3_756
C65 C64 3.488(8) no . 3_756
C66 O1 3.488(8) no . 2_645
C66 C64 3.515(8) no . 3_756
C74 F1 3.577(7) no . 4_554
C77 F1 3.130(7) no . 4_554
C77 F6 3.493(8) no . 4_554
C83 F5 3.470(7) no . .
C84 F9 3.499(7) no . 2_756
C84 F11 3.489(7) no . 2_756
C86 F2 3.477(8) no . .
C86 F4 3.388(7) no . .
C86 F5 3.494(7) no . .
Pt1 H16 3.0870 no . .
Pt1 H26 3.1066 no . .
Pt1 H37A 3.1589 no . .
Pt1 H47A 2.9095 no . .
Pt2 H56 3.0829 no . .
Pt2 H66 3.0996 no . .
Pt2 H77C 2.8541 no . .
Pt2 H87A 3.2683 no . .
Pt2 H87C 3.5253 no . .
Ag1 H26 3.1085 no . .
Ag1 H36A 3.3092 no . .
Ag1 H36B 3.2921 no . .
Ag1 H76A 3.0626 no . .
Ag2 H46B 3.1431 no . .
Ag2 H56 3.1879 no . .
Ag2 H86A 3.3067 no . .
Ag2 H86B 3.4301 no . .
O1 H1A 2.6625 no . .
O1 H1B 2.6406 no . .
O1 H1C 3.1400 no . .
O1 H3A 2.5012 no . .
O1 H3B 2.8295 no . .
O1 H3C 3.0866 no . .
N11 H13 3.2459 no . .
N11 H15 3.2283 no . .
N11 H47A 3.1468 no . .
N21 H23 3.2387 no . .
N21 H25 3.2382 no . .
N31 H26 2.6435 no . .
N31 H34 3.1296 no . .
N31 H37A 2.6356 no . .
N31 H37B 3.2449 no . .
N31 H37C 2.8723 no . .
N32 H26 2.6953 no . .
N32 H34 3.1398 no . .
N32 H36A 2.7335 no . .
N32 H36B 2.6832 no . .
N32 H36C 3.2444 no . .
N41 H16 2.5080 no . .
N41 H37A 3.5593 no . .
N41 H37C 3.2177 no . .
N41 H44 3.1311 no . .
N41 H47A 2.5775 no . .
N41 H47B 2.9794 no . .
N41 H47C 3.1969 no . .
N42 H16 2.8247 no . .
N42 H44 3.1429 no . .
N42 H46A 2.8554 no . .
N42 H46B 2.6214 no . .
N42 H46C 3.2393 no . .
N51 H53 3.2470 no . .
N51 H55 3.2215 no . .
N61 H63 3.2451 no . .
N61 H65 3.2439 no . .
N61 H77C 3.1457 no . .
N71 H66 2.6031 no . .
N71 H74 3.1103 no . .
N71 H77A 3.1305 no . .
N71 H77B 3.0548 no . .
N71 H77C 2.5387 no . .
N71 H87C 2.9929 no . .
N72 H66 3.2761 no . .
N72 H74 3.1347 no . .
N72 H76A 2.6086 no . .
N72 H76B 2.8754 no . .
N72 H76C 3.2339 no . .
N81 H56 2.5661 no . .
N81 H84 3.1242 no . .
N81 H87A 2.6872 no . .
N81 H87B 3.2671 no . .
N81 H87C 2.8205 no . .
N82 H56 2.7143 no . .
N82 H84 3.1423 no . .
N82 H86A 2.7289 no . .
N82 H86B 2.7271 no . .
N82 H86C 3.2641 no . .
C1 H3A 3.3332 no . .
C1 H3B 2.9450 no . .
C1 H3C 2.6098 no . .
C3 H1A 3.1541 no . .
C3 H1B 3.2030 no . .
C3 H1C 2.5291 no . .
C12 H14 3.2466 no . .
C12 H16 3.1940 no . .
C12 H23 2.7137 no . .
C13 H15 3.2493 no . .
C13 H23 2.7555 no . .
C14 H16 3.2339 no . .
C14 H64 3.2475 no . .
C15 H13 3.2491 no . .
C15 H63 3.5117 no . .
C16 H14 3.2397 no . .
C16 H47A 3.3883 no . .
C22 H13 2.7206 no . .
C22 H24 3.2478 no . .
C22 H26 3.1901 no . .
C23 H13 2.7631 no . .
C23 H25 3.2375 no . .
C24 H26 3.2316 no . .
C25 H23 3.2338 no . .
C25 H76B 3.4892 no . .
C26 H24 3.2420 no . .
C33 H26 3.3888 no . .
C33 H86B 3.5453 no . .
C34 H36A 3.1764 no . .
C34 H36B 3.2281 no . .
C34 H36C 2.7080 no . .
C34 H37A 3.3002 no . .
C34 H37B 2.7381 no . .
C34 H37C 3.1050 no . .
C35 H26 3.3282 no . .
C36 H34 2.9399 no . .
C36 H86B 3.1830 no . .
C37 H34 2.9413 no . .
C37 H47A 3.3691 no . .
C37 H47B 3.1733 no . .
C43 H16 3.0833 no . .
C44 H16 2.9632 no . .
C44 H46A 3.0795 no . .
C44 H46B 3.2919 no . .
C44 H46C 2.7245 no . .
C44 H47A 3.3184 no . .
C44 H47B 2.9691 no . .
C44 H47C 2.7569 no . .
C45 H16 2.6008 no . .
C45 H37C 3.2507 no . .
C46 H44 2.9228 no . .
C47 H16 3.3159 no . .
C47 H37A 3.2404 no . .
C47 H37C 3.0783 no . .
C47 H44 2.9051 no . .
C52 H54 3.2461 no . .
C52 H56 3.2075 no . .
C52 H63 2.7141 no . .
C53 H55 3.2464 no . .
C53 H63 2.7522 no . .
C54 H46B 3.3916 no . .
C54 H56 3.2541 no . .
C55 H46B 2.9223 no . .
C55 H53 3.2484 no . .
C56 H46B 3.2170 no . .
C56 H54 3.2582 no . .
C62 H53 2.7262 no . .
C62 H64 3.2390 no . .
C62 H66 3.1879 no . .
C63 H15 3.5784 no . .
C63 H53 2.7521 no . .
C63 H65 3.2616 no . .
C64 H14 3.3217 no . .
C64 H66 3.2325 no . .
C65 H63 3.2608 no . .
C66 H64 3.2387 no . .
C66 H77B 3.2695 no . .
C66 H77C 3.3477 no . .
C74 H66 3.4255 no . .
C74 H76A 3.3030 no . .
C74 H76B 3.0922 no . .
C74 H76C 2.7452 no . .
C74 H77A 2.8517 no . .
C74 H77B 2.9163 no . .
C74 H77C 3.3482 no . .
C75 H66 2.7207 no . .
C75 H87C 2.9454 no . .
C76 H74 2.9389 no . .
C77 H66 3.0558 no . .
C77 H74 2.9293 no . .
C77 H87A 3.4953 no . .
C77 H87C 3.0811 no . .
C83 H36B 3.5894 no . .
C83 H56 3.4033 no . .
C84 H86A 3.1994 no . .
C84 H86B 3.2137 no . .
C84 H86C 2.7108 no . .
C84 H87A 3.2606 no . .
C84 H87B 2.7204 no . .
C84 H87C 3.1535 no . .
C85 H56 3.2261 no . .
C86 H36B 3.1880 no . .
C86 H84 2.9355 no . .
C87 H77A 3.5805 no . .
C87 H77C 3.3618 no . .
C87 H84 2.9345 no . .
H1A H3B 3.3034 no . .
H1A H3C 3.3605 no . .
H1B H3C 3.1753 no . .
H1C H3A 3.4185 no . .
H1C H3B 2.8559 no . .
H1C H3C 2.2654 no . .
H13 H14 2.3449 no . .
H13 H23 2.2188 no . .
H13 H65 3.5284 no . .
H14 H15 2.3303 no . .
H14 H64 2.9740 no . .
H15 H16 2.3289 no . .
H15 H63 3.3140 no . .
H16 H44 3.5532 no . .
H16 H47A 3.2778 no . .
H16 H47C 3.3755 no . .
H23 H24 2.3358 no . .
H24 H25 2.3341 no . .
H25 H26 2.3288 no . .
H25 H76B 3.2881 no . .
H34 H36A 3.5484 no . .
H34 H36C 2.7135 no . .
H34 H37B 2.7557 no . .
H34 H37C 3.3999 no . .
H36A H76A 3.2831 no . .
H36B H86B 2.3091 no . .
H36B H86C 3.5412 no . .
H36C H86B 3.5570 no . .
H37A H47A 2.7777 no . .
H37A H47B 2.9484 no . .
H37C H47A 3.1068 no . .
H37C H47B 2.5250 no . .
H44 H46A 3.3788 no . .
H44 H46C 2.7346 no . .
H44 H47B 3.1942 no . .
H44 H47C 2.8105 no . .
H46B H55 2.9674 no . .
H46B H56 3.4390 no . .
H53 H54 2.3393 no . .
H53 H63 2.2072 no . .
H54 H55 2.3447 no . .
H55 H56 2.3299 no . .
H63 H64 2.3540 no . .
H64 H65 2.3364 no . .
H65 H66 2.3297 no . .
H66 H77B 2.7901 no . .
H66 H77C 3.1204 no . .
H74 H76B 3.3803 no . .
H74 H76C 2.7655 no . .
H74 H77A 2.9626 no . .
H74 H77B 3.0833 no . .
H77A H87A 3.4197 no . .
H77A H87C 2.8577 no . .
H77C H87A 2.9155 no . .
H77C H87C 2.9514 no . .
H84 H86A 3.5717 no . .
H84 H86B 3.5904 no . .
H84 H86C 2.7068 no . .
H84 H87B 2.7170 no . .
H84 H87C 3.4868 no . .
P1 H15 3.1404 no . 2_656
P1 H36C 3.5831 no . 2_646
P1 H46A 3.4958 no . .
P1 H86A 3.2693 no . .
P2 H1A 3.4624 no . 4_555
P2 H13 3.4907 no . 3_756
P2 H25 3.3874 no . 4_555
P2 H47C 3.4259 no . 1_655
P2 H65 3.4615 no . 3_756
P2 H84 3.4849 no . 2_746
F1 H36A 3.4261 no . 2_646
F1 H36C 2.4851 no . 2_646
F1 H46A 2.5746 no . .
F1 H46B 2.9942 no . .
F1 H46C 3.3302 no . .
F1 H55 3.5091 no . .
F1 H74 2.9469 no . 4_455
F1 H77A 2.7023 no . 4_455
F1 H77B 2.7908 no . 4_455
F2 H15 2.6317 no . 2_656
F2 H46A 3.2633 no . .
F2 H53 2.7059 no . 2_656
F2 H63 2.5290 no . 2_656
F2 H77B 3.2507 no . 4_455
F2 H86A 2.5236 no . .
F3 H34 3.3700 no . 2_646
F3 H36C 2.9511 no . 2_646
F3 H37A 3.4395 no . 4_555
F3 H55 2.6589 no . .
F3 H56 3.4826 no . .
F4 H13 3.1266 no . 4_555
F4 H15 2.4493 no . 2_656
F4 H23 3.0617 no . 4_555
F4 H86A 2.7862 no . .
F4 H86C 3.3868 no . .
F5 H46A 2.9070 no . .
F5 H46B 2.6448 no . .
F5 H55 2.8577 no . .
F5 H56 2.4902 no . .
F5 H86A 2.7240 no . .
F6 H14 2.7113 no . 2_656
F6 H15 2.6254 no . 2_656
F6 H47A 2.3846 no . 4_555
F6 H47C 3.2647 no . 4_555
F6 H77A 2.9395 no . 4_455
F6 H77B 3.1777 no . 4_455
F7 H3C 2.9170 no . 3_766
F7 H24 2.4823 no . 4_555
F7 H25 3.1133 no . 4_555
F7 H44 2.8867 no . 1_655
F7 H47B 3.3063 no . 1_655
F7 H47C 3.0642 no . 1_655
F7 H87A 2.9698 no . .
F8 H1A 2.7810 no . 4_555
F8 H1C 3.3720 no . 4_555
F8 H3B 2.7018 no . 4_555
F8 H13 2.8606 no . 3_756
F8 H23 3.1341 no . 3_756
F8 H65 2.5120 no . 3_756
F8 H84 3.5164 no . 2_746
F8 H87B 3.5511 no . 2_746
F9 H1A 3.2620 no . 4_555
F9 H25 2.5531 no . 4_555
F9 H76B 3.2259 no . 4_555
F9 H84 2.6869 no . 2_746
F9 H87B 2.9651 no . 2_746
F10 H13 3.3056 no . 3_756
F10 H14 3.2909 no . 3_756
F10 H47B 3.5294 no . 1_655
F10 H47C 2.7132 no . 1_655
F10 H64 2.3987 no . 3_756
F10 H65 2.7825 no . 3_756
F10 H77C 2.8797 no . .
F11 H13 2.5013 no . 3_756
F11 H14 3.3567 no . 3_756
F11 H23 3.5692 no . 3_756
F11 H44 2.7031 no . 1_655
F11 H47C 2.6519 no . 1_655
F11 H84 2.5766 no . 2_746
F12 H1A 2.6560 no . 4_555
F12 H24 3.0568 no . 4_555
F12 H25 2.7451 no . 4_555
F12 H65 3.5532 no . 3_756
O1 H46A 2.9358 no . 3_666
O1 H53 2.6477 no . 4_454
O1 H63 2.7124 no . 4_454
O1 H65 2.8269 no . 2_655
O1 H66 2.9332 no . 2_655
O1 H77B 3.1930 no . 2_655
N32 H37B 3.5779 no . 3_666
N32 H54 3.5758 no . 2_656
N41 H1B 3.0848 no . 3_666
N41 H1C 3.5721 no . 3_666
N42 H1B 2.9092 no . 3_666
N61 H64 3.5070 no . 3_756
C1 H37C 3.1206 no . 3_666
C1 H53 3.4083 no . 4_454
C1 H54 3.4293 no . 4_454
C2 H46A 3.0987 no . 3_666
C2 H53 3.3824 no . 4_454
C2 H65 3.1575 no . 2_655
C2 H66 3.4432 no . 2_655
C3 H24 3.5225 no . 2_655
C3 H44 3.3754 no . 3_666
C3 H65 3.4591 no . 2_655
C3 H66 3.2401 no . 2_655
C13 H15 3.5794 no . 3_656
C14 H15 3.5112 no . 3_656
C14 H47C 3.3015 no . 3_656
C15 H14 3.5482 no . 3_656
C16 H14 3.5459 no . 3_656
C22 H3B 3.4952 no . 2_645
C23 H3B 2.7898 no . 2_645
C24 H3B 3.0229 no . 2_645
C24 H3C 3.3530 no . 2_645
C24 H56 3.2477 no . 4_454
C25 H34 3.1781 no . 3_666
C25 H55 3.3672 no . 4_454
C26 H34 2.8658 no . 3_666
C26 H37B 3.5616 no . 3_666
C33 H37A 3.4787 no . 3_666
C33 H37B 3.1655 no . 3_666
C33 H54 2.9754 no . 2_656
C33 H55 3.3849 no . 2_656
C34 H26 3.2657 no . 3_666
C34 H37A 3.4507 no . 3_666
C34 H37B 3.4037 no . 3_666
C34 H54 2.9727 no . 2_656
C34 H55 3.0765 no . 2_656
C35 H34 3.5434 no . 3_666
C36 H37A 3.4030 no . 3_666
C36 H37B 3.3968 no . 3_666
C36 H46C 3.3841 no . 2_656
C36 H54 3.3417 no . 2_656
C36 H55 3.2702 no . 2_656
C36 H74 2.8883 no . 3_766
C37 H1C 3.5613 no . 3_666
C37 H26 3.5806 no . 3_666
C37 H36A 3.4340 no . 3_666
C43 H1B 2.9670 no . 3_666
C43 H86C 3.4046 no . 2_646
C44 H1B 3.2083 no . 3_666
C44 H1C 3.2051 no . 3_666
C44 H3C 3.0024 no . 3_666
C44 H86C 3.3513 no . 2_646
C45 H1B 3.2697 no . 3_666
C45 H1C 3.1769 no . 3_666
C46 H36B 3.4413 no . 2_646
C46 H36C 3.4994 no . 2_646
C46 H74 3.2218 no . 4_455
C46 H86B 3.5876 no . 2_646
C46 H86C 3.4198 no . 2_646
C47 H14 3.0960 no . 3_656
C47 H77A 3.2484 no . 1_455
C53 H1A 3.1730 no . 4_555
C53 H1B 3.5147 no . 4_555
C53 H86A 3.4213 no . 2_646
C53 H86B 3.5323 no . 2_646
C54 H1A 3.1051 no . 4_555
C54 H1B 3.3955 no . 4_555
C54 H34 3.4927 no . 2_646
C54 H86A 3.5617 no . 2_646
C54 H86B 3.0610 no . 2_646
C55 H34 3.2197 no . 2_646
C55 H36C 3.2919 no . 2_646
C56 H24 3.3700 no . 4_555
C62 H65 3.5515 no . 3_756
C63 H65 3.4118 no . 3_756
C63 H77B 3.2163 no . 3_756
C64 H77B 3.1244 no . 3_756
C64 H77C 3.3593 no . 3_756
C65 H3B 3.5886 no . 2_645
C66 H3A 3.5899 no . 2_645
C66 H64 3.4400 no . 3_756
C73 H3A 3.1741 no . 2_645
C73 H76A 3.5046 no . 3_766
C74 H3A 3.1239 no . 2_645
C74 H36A 3.0566 no . 3_766
C74 H36B 3.5258 no . 3_766
C74 H46C 3.4391 no . 4_554
C75 H3A 3.5825 no . 2_645
C77 H47B 3.5336 no . 1_655
C77 H64 2.9175 no . 3_756
C83 H76C 3.5388 no . 3_766
C84 H23 3.4182 no . 4_555
C84 H76C 3.1411 no . 3_766
C85 H76C 3.4488 no . 3_766
C86 H46C 3.3491 no . 2_656
C86 H54 3.3471 no . 2_656
C87 H24 3.4742 no . 4_555
C87 H47B 3.3693 no . 1_655
H1A P2 3.4624 no . 4_454
H1A F8 2.7810 no . 4_454
H1A F9 3.2620 no . 4_454
H1A F12 2.6560 no . 4_454
H1A C53 3.1730 no . 4_454
H1A C54 3.1051 no . 4_454
H1A H37C 3.2125 no . 3_666
H1A H53 3.1681 no . 4_454
H1A H54 3.0341 no . 4_454
H1B N41 3.0848 no . 3_666
H1B N42 2.9092 no . 3_666
H1B C43 2.9670 no . 3_666
H1B C44 3.2083 no . 3_666
H1B C45 3.2697 no . 3_666
H1B C53 3.5147 no . 4_454
H1B C54 3.3955 no . 4_454
H1B H37C 3.0371 no . 3_666
H1B H46A 3.1865 no . 3_666
H1B H53 3.1715 no . 4_454
H1B H54 2.9298 no . 4_454
H1C F8 3.3720 no . 4_454
H1C N41 3.5721 no . 3_666
H1C C37 3.5613 no . 3_666
H1C C44 3.2051 no . 3_666
H1C C45 3.1769 no . 3_666
H1C H37C 2.6147 no . 3_666
H1C H44 3.4449 no . 3_666
H1C H47B 3.0386 no . 3_666
H1C H87B 2.9307 no . 3_766
H3A C66 3.5899 no . 2_655
H3A C73 3.1741 no . 2_655
H3A C74 3.1239 no . 2_655
H3A C75 3.5825 no . 2_655
H3A H44 3.5098 no . 3_666
H3A H46A 3.5271 no . 3_666
H3A H66 2.7579 no . 2_655
H3A H74 3.3016 no . 2_655
H3A H76B 3.1577 no . 2_655
H3B F8 2.7018 no . 4_454
H3B C22 3.4952 no . 2_655
H3B C23 2.7898 no . 2_655
H3B C24 3.0229 no . 2_655
H3B C65 3.5886 no . 2_655
H3B H23 2.7048 no . 2_655
H3B H24 3.1051 no . 2_655
H3B H65 3.0161 no . 2_655
H3B H66 3.1431 no . 2_655
H3C F7 2.9170 no . 3_766
H3C C24 3.3530 no . 2_655
H3C C44 3.0024 no . 3_666
H3C H24 3.0976 no . 2_655
H3C H44 2.6010 no . 3_666
H13 P2 3.4907 no . 3_756
H13 F4 3.1266 no . 4_454
H13 F8 2.8606 no . 3_756
H13 F10 3.3056 no . 3_756
H13 F11 2.5013 no . 3_756
H14 F6 2.7113 no . 2_646
H14 F10 3.2909 no . 3_756
H14 F11 3.3567 no . 3_756
H14 C15 3.5482 no . 3_656
H14 C16 3.5459 no . 3_656
H14 C47 3.0960 no . 3_656
H14 H47A 2.9520 no . 3_656
H14 H47C 2.4003 no . 3_656
H15 P1 3.1404 no . 2_646
H15 F2 2.6317 no . 2_646
H15 F4 2.4493 no . 2_646
H15 F6 2.6254 no . 2_646
H15 C13 3.5794 no . 3_656
H15 C14 3.5112 no . 3_656
H15 H86A 3.5529 no . 2_646
H16 H86C 3.3813 no . 2_646
H23 F4 3.0617 no . 4_454
H23 F8 3.1341 no . 3_756
H23 F11 3.5692 no . 3_756
H23 C84 3.4182 no . 4_454
H23 H3B 2.7048 no . 2_645
H23 H84 3.2700 no . 4_454
H24 F7 2.4823 no . 4_454
H24 F12 3.0568 no . 4_454
H24 C3 3.5225 no . 2_645
H24 C56 3.3700 no . 4_454
H24 C87 3.4742 no . 4_454
H24 H3B 3.1051 no . 2_645
H24 H3C 3.0976 no . 2_645
H24 H56 2.9535 no . 4_454
H24 H87A 2.8757 no . 4_454
H24 H87B 3.5249 no . 4_454
H25 P2 3.3874 no . 4_454
H25 F7 3.1133 no . 4_454
H25 F9 2.5531 no . 4_454
H25 F12 2.7451 no . 4_454
H25 H34 3.1040 no . 3_666
H25 H37B 3.4882 no . 3_666
H25 H55 3.3997 no . 4_454
H26 C34 3.2657 no . 3_666
H26 C37 3.5806 no . 3_666
H26 H34 2.5228 no . 3_666
H26 H37B 2.7285 no . 3_666
H34 F3 3.3700 no . 2_656
H34 C25 3.1781 no . 3_666
H34 C26 2.8658 no . 3_666
H34 C35 3.5434 no . 3_666
H34 C54 3.4927 no . 2_656
H34 C55 3.2197 no . 2_656
H34 H25 3.1040 no . 3_666
H34 H26 2.5228 no . 3_666
H34 H37A 3.3030 no . 3_666
H34 H54 3.0867 no . 2_656
H34 H55 2.5350 no . 2_656
H36A F1 3.4261 no . 2_656
H36A C37 3.4340 no . 3_666
H36A C74 3.0566 no . 3_766
H36A H37A 3.0783 no . 3_666
H36A H37B 2.8836 no . 3_666
H36A H74 2.5253 no . 3_766
H36A H77A 3.5793 no . 3_766
H36B C46 3.4413 no . 2_656
H36B C74 3.5258 no . 3_766
H36B H46B 3.3024 no . 2_656
H36B H46C 2.7556 no . 2_656
H36B H54 3.1304 no . 2_656
H36B H55 3.4909 no . 2_656
H36B H74 2.7329 no . 3_766
H36B H76C 3.4683 no . 3_766
H36C P1 3.5831 no . 2_656
H36C F1 2.4851 no . 2_656
H36C F3 2.9511 no . 2_656
H36C C46 3.4994 no . 2_656
H36C C55 3.2919 no . 2_656
H36C H37A 3.1862 no . 3_666
H36C H46B 3.1360 no . 2_656
H36C H46C 3.1862 no . 2_656
H36C H54 3.3153 no . 2_656
H36C H55 2.5860 no . 2_656
H36C H74 2.9258 no . 3_766
H37A F3 3.4395 no . 4_454
H37A C33 3.4787 no . 3_666
H37A C34 3.4507 no . 3_666
H37A C36 3.4030 no . 3_666
H37A H34 3.3030 no . 3_666
H37A H36A 3.0783 no . 3_666
H37A H36C 3.1862 no . 3_666
H37A H77A 3.4788 no . 1_455
H37B N32 3.5779 no . 3_666
H37B C26 3.5616 no . 3_666
H37B C33 3.1655 no . 3_666
H37B C34 3.4037 no . 3_666
H37B C36 3.3968 no . 3_666
H37B H25 3.4882 no . 3_666
H37B H26 2.7285 no . 3_666
H37B H36A 2.8836 no . 3_666
H37C C1 3.1206 no . 3_666
H37C H1A 3.2125 no . 3_666
H37C H1B 3.0371 no . 3_666
H37C H1C 2.6147 no . 3_666
H37C H87B 3.3789 no . 1_455
H37C H87C 3.4983 no . 1_455
H44 F7 2.8867 no . 1_455
H44 F11 2.7031 no . 1_455
H44 C3 3.3754 no . 3_666
H44 H1C 3.4449 no . 3_666
H44 H3A 3.5098 no . 3_666
H44 H3C 2.6010 no . 3_666
H44 H84 3.5262 no . 2_646
H44 H86C 3.1797 no . 2_646
H46A P1 3.4958 no . .
H46A F1 2.5746 no . .
H46A F2 3.2633 no . .
H46A F5 2.9070 no . .
H46A O1 2.9358 no . 3_666
H46A C2 3.0987 no . 3_666
H46A H1B 3.1865 no . 3_666
H46A H3A 3.5271 no . 3_666
H46A H74 2.9890 no . 4_455
H46B F1 2.9942 no . .
H46B F5 2.6448 no . .
H46B H36B 3.3024 no . 2_646
H46B H36C 3.1360 no . 2_646
H46B H86B 3.4150 no . 2_646
H46B H86C 3.5192 no . 2_646
H46C F1 3.3302 no . .
H46C C36 3.3841 no . 2_646
H46C C74 3.4391 no . 4_455
H46C C86 3.3491 no . 2_646
H46C H36B 2.7556 no . 2_646
H46C H36C 3.1862 no . 2_646
H46C H74 2.6072 no . 4_455
H46C H86B 2.9601 no . 2_646
H46C H86C 2.8752 no . 2_646
H47A F6 2.3846 no . 4_454
H47A H14 2.9520 no . 3_656
H47A H77A 3.0222 no . 1_455
H47B F7 3.3063 no . 1_455
H47B F10 3.5294 no . 1_455
H47B C77 3.5336 no . 1_455
H47B C87 3.3693 no . 1_455
H47B H1C 3.0386 no . 3_666
H47B H77A 2.8387 no . 1_455
H47B H77C 3.3395 no . 1_455
H47B H87A 2.9625 no . 1_455
H47B H87B 3.3749 no . 1_455
H47B H87C 3.2199 no . 1_455
H47C P2 3.4259 no . 1_455
H47C F6 3.2647 no . 4_454
H47C F7 3.0642 no . 1_455
H47C F10 2.7132 no . 1_455
H47C F11 2.6519 no . 1_455
H47C C14 3.3015 no . 3_656
H47C H14 2.4003 no . 3_656
H47C H77A 3.3635 no . 1_455
H47C H77C 3.5194 no . 1_455
H53 F2 2.7059 no . 2_646
H53 O1 2.6477 no . 4_555
H53 C1 3.4083 no . 4_555
H53 C2 3.3824 no . 4_555
H53 H1A 3.1681 no . 4_555
H53 H1B 3.1715 no . 4_555
H53 H86A 2.9638 no . 2_646
H53 H86B 3.4588 no . 2_646
H54 N32 3.5758 no . 2_646
H54 C1 3.4293 no . 4_555
H54 C33 2.9754 no . 2_646
H54 C34 2.9727 no . 2_646
H54 C36 3.3417 no . 2_646
H54 C86 3.3471 no . 2_646
H54 H1A 3.0341 no . 4_555
H54 H1B 2.9298 no . 4_555
H54 H34 3.0867 no . 2_646
H54 H36B 3.1304 no . 2_646
H54 H36C 3.3153 no . 2_646
H54 H86A 3.2482 no . 2_646
H54 H86B 2.6072 no . 2_646
H55 F1 3.5091 no . .
H55 F3 2.6589 no . .
H55 F5 2.8577 no . .
H55 C25 3.3672 no . 4_555
H55 C33 3.3849 no . 2_646
H55 C34 3.0765 no . 2_646
H55 C36 3.2702 no . 2_646
H55 H25 3.3997 no . 4_555
H55 H34 2.5350 no . 2_646
H55 H36B 3.4909 no . 2_646
H55 H36C 2.5860 no . 2_646
H56 F3 3.4826 no . .
H56 F5 2.4902 no . .
H56 C24 3.2477 no . 4_555
H56 H24 2.9535 no . 4_555
H63 F2 2.5290 no . 2_646
H63 O1 2.7124 no . 4_555
H63 H65 3.5461 no . 3_756
H63 H77B 2.6986 no . 3_756
H64 F10 2.3987 no . 3_756
H64 N61 3.5070 no . 3_756
H64 C66 3.4400 no . 3_756
H64 C77 2.9175 no . 3_756
H64 H77A 3.4251 no . 3_756
H64 H77B 2.5037 no . 3_756
H64 H77C 2.4934 no . 3_756
H65 P2 3.4615 no . 3_756
H65 F8 2.5120 no . 3_756
H65 F10 2.7825 no . 3_756
H65 F12 3.5532 no . 3_756
H65 O1 2.8269 no . 2_645
H65 C2 3.1575 no . 2_645
H65 C3 3.4591 no . 2_645
H65 C62 3.5515 no . 3_756
H65 C63 3.4118 no . 3_756
H65 H3B 3.0161 no . 2_645
H65 H63 3.5461 no . 3_756
H66 O1 2.9332 no . 2_645
H66 C2 3.4432 no . 2_645
H66 C3 3.2401 no . 2_645
H66 H3A 2.7579 no . 2_645
H66 H3B 3.1431 no . 2_645
H74 F1 2.9469 no . 4_554
H74 C36 2.8883 no . 3_766
H74 C46 3.2218 no . 4_554
H74 H3A 3.3016 no . 2_645
H74 H36A 2.5253 no . 3_766
H74 H36B 2.7329 no . 3_766
H74 H36C 2.9258 no . 3_766
H74 H46A 2.9890 no . 4_554
H74 H46C 2.6072 no . 4_554
H76A C73 3.5046 no . 3_766
H76A H76A 3.4172 no . 3_766
H76A H76C 3.5257 no . 3_766
H76A H87C 3.4448 no . 3_766
H76B F9 3.2259 no . 4_454
H76B H3A 3.1577 no . 2_645
H76B H84 3.5230 no . 3_766
H76C C83 3.5388 no . 3_766
H76C C84 3.1411 no . 3_766
H76C C85 3.4488 no . 3_766
H76C H36B 3.4683 no . 3_766
H76C H76A 3.5257 no . 3_766
H76C H84 3.2045 no . 3_766
H77A F1 2.7023 no . 4_554
H77A F6 2.9395 no . 4_554
H77A C47 3.2484 no . 1_655
H77A H36A 3.5793 no . 3_766
H77A H37A 3.4788 no . 1_655
H77A H47A 3.0222 no . 1_655
H77A H47B 2.8387 no . 1_655
H77A H47C 3.3635 no . 1_655
H77A H64 3.4251 no . 3_756
H77B F1 2.7908 no . 4_554
H77B F2 3.2507 no . 4_554
H77B F6 3.1777 no . 4_554
H77B O1 3.1930 no . 2_645
H77B C63 3.2163 no . 3_756
H77B C64 3.1244 no . 3_756
H77B H63 2.6986 no . 3_756
H77B H64 2.5037 no . 3_756
H77C F10 2.8797 no . .
H77C C64 3.3593 no . 3_756
H77C H47B 3.3395 no . 1_655
H77C H47C 3.5194 no . 1_655
H77C H64 2.4934 no . 3_756
H84 P2 3.4849 no . 2_756
H84 F8 3.5164 no . 2_756
H84 F9 2.6869 no . 2_756
H84 F11 2.5766 no . 2_756
H84 H23 3.2700 no . 4_555
H84 H44 3.5262 no . 2_656
H84 H76B 3.5230 no . 3_766
H84 H76C 3.2045 no . 3_766
H86A P1 3.2693 no . .
H86A F2 2.5236 no . .
H86A F4 2.7862 no . .
H86A F5 2.7240 no . .
H86A C53 3.4213 no . 2_656
H86A C54 3.5617 no . 2_656
H86A H15 3.5529 no . 2_656
H86A H53 2.9638 no . 2_656
H86A H54 3.2482 no . 2_656
H86B C46 3.5876 no . 2_656
H86B C53 3.5323 no . 2_656
H86B C54 3.0610 no . 2_656
H86B H46B 3.4150 no . 2_656
H86B H46C 2.9601 no . 2_656
H86B H53 3.4588 no . 2_656
H86B H54 2.6072 no . 2_656
H86C F4 3.3868 no . .
H86C C43 3.4046 no . 2_656
H86C C44 3.3513 no . 2_656
H86C C46 3.4198 no . 2_656
H86C H16 3.3813 no . 2_656
H86C H44 3.1797 no . 2_656
H86C H46B 3.5192 no . 2_656
H86C H46C 2.8752 no . 2_656
H87A F7 2.9698 no . .
H87A H24 2.8757 no . 4_555
H87A H47B 2.9625 no . 1_655
H87B F8 3.5511 no . 2_756
H87B F9 2.9651 no . 2_756
H87B H1C 2.9307 no . 3_766
H87B H24 3.5249 no . 4_555
H87B H37C 3.3789 no . 1_655
H87B H47B 3.3749 no . 1_655
H87C H37C 3.4983 no . 1_655
H87C H47B 3.2199 no . 1_655
H87C H76A 3.4448 no . 3_766
_chemical_name_systematic        '[Pt2Ag2(bpy)2(Me2pz)4](PF6)2'
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: acetone/n-hexane'
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_5d
_database_code_depnum_ccdc_archive 'CCDC 1438727'
_audit_update_record             
;
2015-11-25 deposited with the CCDC.
2016-02-22 downloaded from the CCDC.
;
#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C44 H50 Au2 F12 N14 P2 Pt2'
_chemical_formula_moiety         'C44 H50 Au2 F12 N14 P2 Pt2'
_chemical_formula_weight         1849.01
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_space_group_crystal_system      triclinic
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
_space_group_IT_number           2
loop_
_symmetry_equiv_pos_site_id
_space_group_symop_operation_xyz
1 +X,+Y,+Z
2 -X,-Y,-Z
#------------------------------------------------------------------------------
_cell_length_a                   10.2943(13)
_cell_length_b                   11.4915(15)
_cell_length_c                   12.268(2)
_cell_angle_alpha                86.513(5)
_cell_angle_beta                 88.377(5)
_cell_angle_gamma                65.233(4)
_cell_volume                     1315.3(3)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    4574
_cell_measurement_theta_min      3.33
_cell_measurement_theta_max      27.48
_cell_measurement_temperature    93
#------------------------------------------------------------------------------
_exptl_crystal_description       prism
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.070
_exptl_crystal_size_min          0.070
_exptl_crystal_density_diffrn    2.334
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             864.00
_exptl_absorpt_coefficient_mu    11.011
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_absorpt_correction_T_min  0.389
_exptl_absorpt_correction_T_max  0.463

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      93
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku Saturn724'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 7.111
_diffrn_reflns_number            10943
_diffrn_reflns_av_R_equivalents  0.0210
_diffrn_reflns_theta_max         27.480
_diffrn_reflns_theta_min         3.328
_diffrn_reflns_theta_full        27.480
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measured_fraction_theta_full 0.984
_diffrn_reflns_Laue_measured_fraction_max 0.000
_diffrn_reflns_Laue_measured_fraction_full 0.000
_diffrn_reflns_point_group_measured_fraction_max 0.000
_diffrn_reflns_point_group_measured_fraction_full 0.000
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       15
_diffrn_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             5934
_reflns_number_gt                4775
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_all          0.0252
_refine_ls_R_factor_gt           0.0183
_refine_ls_wR_factor_ref         0.0381
_refine_ls_wR_factor_gt          0.0372
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         5934
_refine_ls_number_parameters     348
_refine_ls_goodness_of_fit_ref   0.933
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0124P)²+0.0000P] 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          0.003
_refine_diff_density_max         1.39
_refine_diff_density_min         -1.06
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
H H 0.0000 0.0000
;
International Tables for Crystallography
(Vol. C, Table 6.1.1.4)
;
Au Au -2.0133 8.8022
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
F F 0.0171 0.0103
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
N N 0.0061 0.0033
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
P P 0.1023 0.0942
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Pt Pt -1.7033 8.3905
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
C C 0.0033 0.0016
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 1.130782(14) 0.367805(12) -0.003166(10) 0.01072(4) Uani 1 2 d . . .
Pt1 Pt 0.913050(13) 0.450654(12) 0.234725(10) 0.00927(4) Uani 1 2 d . . .
P1 P 0.71565(10) 0.14681(9) 0.59325(8) 0.0143(2) Uani 1 2 d . . .
F1 F 0.5565(2) 0.1973(2) 0.64211(18) 0.0243(5) Uani 1 2 d . . .
F2 F 0.6727(2) 0.28250(19) 0.52479(17) 0.0197(5) Uani 1 2 d . . .
F3 F 0.7578(2) 0.0125(2) 0.6606(2) 0.0306(6) Uani 1 2 d . . .
F4 F 0.7636(2) 0.2025(2) 0.69319(18) 0.0259(5) Uani 1 2 d . . .
F5 F 0.8731(2) 0.0968(2) 0.54336(19) 0.0242(5) Uani 1 2 d . . .
F6 F 0.6660(2) 0.0924(2) 0.49240(18) 0.0244(5) Uani 1 2 d . . .
N1 N 0.4456(4) 0.0262(4) 0.8420(3) 0.0421(10) Uani 1 2 d . . .
N11 N 0.8887(3) 0.6059(3) 0.3160(2) 0.0101(6) Uani 1 2 d . . .
N21 N 1.1051(3) 0.3811(3) 0.3085(2) 0.0093(6) Uani 1 2 d . . .
N31 N 0.9488(3) 0.2929(3) 0.1523(2) 0.0113(6) Uani 1 2 d . . .
N32 N 0.9927(3) 0.2940(3) 0.0448(2) 0.0122(6) Uani 1 2 d . . .
N41 N 0.7208(3) 0.5325(3) 0.1628(2) 0.0110(6) Uani 1 2 d . . .
N42 N 0.7130(3) 0.5844(3) 0.0584(2) 0.0116(6) Uani 1 2 d . . .
C2 C 0.5488(5) 0.0316(4) 0.8703(3) 0.0310(10) Uani 1 2 d . . .
C3 C 0.6781(4) 0.0362(4) 0.9091(3) 0.0302(10) Uani 1 2 d . . .
C12 C 1.0061(4) 0.5937(3) 0.3720(3) 0.0123(7) Uani 1 2 d . . .
C13 C 1.0060(4) 0.6947(4) 0.4281(3) 0.0158(8) Uani 1 2 d . . .
C14 C 0.8853(4) 0.8090(3) 0.4270(3) 0.0187(8) Uani 1 2 d . . .
C15 C 0.7670(4) 0.8206(3) 0.3693(3) 0.0171(8) Uani 1 2 d . . .
C16 C 0.7720(4) 0.7179(3) 0.3140(3) 0.0164(8) Uani 1 2 d . . .
C22 C 1.1279(4) 0.4672(3) 0.3674(3) 0.0118(7) Uani 1 2 d . . .
C23 C 1.2578(4) 0.4337(4) 0.4190(3) 0.0150(8) Uani 1 2 d . . .
C24 C 1.3635(4) 0.3110(4) 0.4094(3) 0.0196(8) Uani 1 2 d . . .
C25 C 1.3388(4) 0.2237(4) 0.3508(3) 0.0204(8) Uani 1 2 d . . .
C26 C 1.2082(4) 0.2623(3) 0.3000(3) 0.0168(8) Uani 1 2 d . . .
C33 C 0.9640(4) 0.2069(3) -0.0061(3) 0.0141(7) Uani 1 2 d . . .
C34 C 0.9020(4) 0.1499(3) 0.0677(3) 0.0157(8) Uani 1 2 d . . .
C35 C 0.8940(4) 0.2057(3) 0.1667(3) 0.0130(7) Uani 1 2 d . . .
C36 C 0.9997(4) 0.1860(4) -0.1240(3) 0.0225(9) Uani 1 2 d . . .
C37 C 0.8447(4) 0.1748(4) 0.2763(3) 0.0203(8) Uani 1 2 d . . .
C43 C 0.5773(4) 0.6268(3) 0.0247(3) 0.0156(8) Uani 1 2 d . . .
C44 C 0.4972(4) 0.6017(3) 0.1081(3) 0.0166(8) Uani 1 2 d . . .
C45 C 0.5897(4) 0.5426(3) 0.1941(3) 0.0153(8) Uani 1 2 d . . .
C46 C 0.5325(4) 0.6881(4) -0.0870(3) 0.0198(8) Uani 1 2 d . . .
C47 C 0.5638(4) 0.4944(4) 0.3041(3) 0.0197(8) Uani 1 2 d . . .
H3A H 0.76137 -0.02718 0.87266 0.0362 Uiso 1 2 calc R . .
H3B H 0.68623 0.01688 0.9882 0.0362 Uiso 1 2 calc R . .
H3C H 0.67425 0.1222 0.89278 0.0362 Uiso 1 2 calc R . .
H13 H 1.08859 0.68532 0.46702 0.0189 Uiso 1 2 calc R . .
H14 H 0.88356 0.87891 0.4656 0.0225 Uiso 1 2 calc R . .
H15 H 0.68283 0.89864 0.36767 0.0205 Uiso 1 2 calc R . .
H16 H 0.69083 0.7266 0.27341 0.0197 Uiso 1 2 calc R . .
H23 H 1.27389 0.49383 0.46019 0.0180 Uiso 1 2 calc R . .
H24 H 1.45359 0.28685 0.4434 0.0236 Uiso 1 2 calc R . .
H25 H 1.41018 0.13864 0.34549 0.0244 Uiso 1 2 calc R . .
H26 H 1.19109 0.20335 0.25804 0.0202 Uiso 1 2 calc R . .
H34 H 0.87079 0.08531 0.05365 0.0188 Uiso 1 2 calc R . .
H36A H 1.10381 0.14544 -0.1332 0.0269 Uiso 1 2 calc R . .
H36B H 0.96022 0.26866 -0.16583 0.0269 Uiso 1 2 calc R . .
H36C H 0.9584 0.13006 -0.15045 0.0269 Uiso 1 2 calc R . .
H37A H 0.82763 0.24492 0.32433 0.0244 Uiso 1 2 calc R . .
H37B H 0.91845 0.09505 0.30823 0.0244 Uiso 1 2 calc R . .
H37C H 0.75591 0.16435 0.2679 0.0244 Uiso 1 2 calc R . .
H44 H 0.39797 0.62133 0.10639 0.0200 Uiso 1 2 calc R . .
H46A H 0.43301 0.70296 -0.09945 0.0237 Uiso 1 2 calc R . .
H46B H 0.59436 0.63133 -0.14156 0.0237 Uiso 1 2 calc R . .
H46C H 0.54073 0.77014 -0.09314 0.0237 Uiso 1 2 calc R . .
H47A H 0.63359 0.4964 0.35586 0.0236 Uiso 1 2 calc R . .
H47B H 0.5739 0.40604 0.3005 0.0236 Uiso 1 2 calc R . .
H47C H 0.4669 0.54897 0.32858 0.0236 Uiso 1 2 calc R . .



#==============================================================================
_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
_computing_cell_refinement       CrystalClear
_computing_data_reduction        CrystalClear
_computing_structure_solution    'Il Milione (Burla, et al., 2007)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_publication_material  'CrystalStructure 4.1 (Rigaku, 2014)'
_computing_molecular_graphics    'CrystalStructure 4.1'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Au1 N32 1.997(4) yes . .
Au1 N42 1.995(3) yes . 2_765
Pt1 N11 2.016(3) yes . .
Pt1 N21 2.013(3) yes . .
Pt1 N31 2.022(3) yes . .
Pt1 N41 2.005(3) yes . .
P1 F1 1.603(2) yes . .
P1 F2 1.618(2) yes . .
P1 F3 1.599(3) yes . .
P1 F4 1.597(3) yes . .
P1 F5 1.593(2) yes . .
P1 F6 1.606(3) yes . .
N1 C2 1.153(7) yes . .
N11 C12 1.358(5) yes . .
N11 C16 1.343(4) yes . .
N21 C22 1.360(5) yes . .
N21 C26 1.341(4) yes . .
N31 N32 1.383(4) yes . .
N31 C35 1.341(6) yes . .
N32 C33 1.347(5) yes . .
N41 N42 1.369(4) yes . .
N41 C45 1.352(5) yes . .
N42 C43 1.341(5) yes . .
C2 C3 1.450(7) yes . .
C12 C13 1.384(6) yes . .
C12 C22 1.472(4) yes . .
C13 C14 1.379(4) yes . .
C14 C15 1.380(6) yes . .
C15 C16 1.379(6) yes . .
C22 C23 1.388(5) yes . .
C23 C24 1.383(5) yes . .
C24 C25 1.379(6) yes . .
C25 C26 1.381(5) yes . .
C33 C34 1.378(6) yes . .
C33 C36 1.491(5) yes . .
C34 C35 1.393(5) yes . .
C35 C37 1.498(5) yes . .
C43 C44 1.387(6) yes . .
C43 C46 1.493(5) yes . .
C44 C45 1.382(5) yes . .
C45 C47 1.487(5) yes . .
C3 H3A 0.980 no . .
C3 H3B 0.980 no . .
C3 H3C 0.980 no . .
C13 H13 0.950 no . .
C14 H14 0.950 no . .
C15 H15 0.950 no . .
C16 H16 0.950 no . .
C23 H23 0.950 no . .
C24 H24 0.950 no . .
C25 H25 0.950 no . .
C26 H26 0.950 no . .
C34 H34 0.950 no . .
C36 H36A 0.980 no . .
C36 H36B 0.980 no . .
C36 H36C 0.980 no . .
C37 H37A 0.980 no . .
C37 H37B 0.980 no . .
C37 H37C 0.980 no . .
C44 H44 0.950 no . .
C46 H46A 0.980 no . .
C46 H46B 0.980 no . .
C46 H46C 0.980 no . .
C47 H47A 0.980 no . .
C47 H47B 0.980 no . .
C47 H47C 0.980 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
N32 Au1 N42 171.50(11) yes . . 2_765
N11 Pt1 N21 80.92(11) yes . . .
N11 Pt1 N31 176.90(12) yes . . .
N11 Pt1 N41 95.28(12) yes . . .
N21 Pt1 N31 96.48(11) yes . . .
N21 Pt1 N41 175.92(13) yes . . .
N31 Pt1 N41 87.27(12) yes . . .
F1 P1 F2 89.84(11) yes . . .
F1 P1 F3 90.12(13) yes . . .
F1 P1 F4 90.07(13) yes . . .
F1 P1 F5 179.36(13) yes . . .
F1 P1 F6 89.58(13) yes . . .
F2 P1 F3 179.78(15) yes . . .
F2 P1 F4 89.78(13) yes . . .
F2 P1 F5 89.83(12) yes . . .
F2 P1 F6 89.70(12) yes . . .
F3 P1 F4 90.44(14) yes . . .
F3 P1 F5 90.20(12) yes . . .
F3 P1 F6 90.09(14) yes . . .
F4 P1 F5 90.47(13) yes . . .
F4 P1 F6 179.37(11) yes . . .
F5 P1 F6 89.88(13) yes . . .
Pt1 N11 C12 114.8(2) yes . . .
Pt1 N11 C16 125.7(3) yes . . .
C12 N11 C16 119.4(3) yes . . .
Pt1 N21 C22 114.45(18) yes . . .
Pt1 N21 C26 125.4(3) yes . . .
C22 N21 C26 120.1(3) yes . . .
Pt1 N31 N32 116.6(2) yes . . .
Pt1 N31 C35 130.6(2) yes . . .
N32 N31 C35 108.6(3) yes . . .
Au1 N32 N31 122.2(3) yes . . .
Au1 N32 C33 127.0(2) yes . . .
N31 N32 C33 107.7(3) yes . . .
Pt1 N41 N42 118.1(2) yes . . .
Pt1 N41 C45 132.8(2) yes . . .
N42 N41 C45 109.0(3) yes . . .
Au1 N42 N41 119.0(2) yes 2_765 . .
Au1 N42 C43 130.0(3) yes 2_765 . .
N41 N42 C43 107.9(3) yes . . .
N1 C2 C3 178.1(5) yes . . .
N11 C12 C13 120.8(3) yes . . .
N11 C12 C22 114.6(3) yes . . .
C13 C12 C22 124.6(3) yes . . .
C12 C13 C14 119.6(4) yes . . .
C13 C14 C15 119.1(4) yes . . .
C14 C15 C16 119.4(3) yes . . .
N11 C16 C15 121.6(4) yes . . .
N21 C22 C12 115.1(3) yes . . .
N21 C22 C23 120.6(3) yes . . .
C12 C22 C23 124.3(4) yes . . .
C22 C23 C24 118.7(4) yes . . .
C23 C24 C25 120.3(4) yes . . .
C24 C25 C26 118.7(3) yes . . .
N21 C26 C25 121.5(4) yes . . .
N32 C33 C34 108.9(3) yes . . .
N32 C33 C36 120.3(4) yes . . .
C34 C33 C36 130.8(4) yes . . .
C33 C34 C35 106.5(4) yes . . .
N31 C35 C34 108.2(3) yes . . .
N31 C35 C37 122.1(3) yes . . .
C34 C35 C37 129.6(4) yes . . .
N42 C43 C44 108.7(3) yes . . .
N42 C43 C46 121.6(3) yes . . .
C44 C43 C46 129.8(3) yes . . .
C43 C44 C45 106.8(3) yes . . .
N41 C45 C44 107.6(3) yes . . .
N41 C45 C47 121.7(3) yes . . .
C44 C45 C47 130.6(4) yes . . .
C2 C3 H3A 109.469 no . . .
C2 C3 H3B 109.475 no . . .
C2 C3 H3C 109.465 no . . .
H3A C3 H3B 109.477 no . . .
H3A C3 H3C 109.469 no . . .
H3B C3 H3C 109.472 no . . .
C12 C13 H13 120.219 no . . .
C14 C13 H13 120.215 no . . .
C13 C14 H14 120.430 no . . .
C15 C14 H14 120.440 no . . .
C14 C15 H15 120.298 no . . .
C16 C15 H15 120.303 no . . .
N11 C16 H16 119.183 no . . .
C15 C16 H16 119.194 no . . .
C22 C23 H23 120.643 no . . .
C24 C23 H23 120.644 no . . .
C23 C24 H24 119.830 no . . .
C25 C24 H24 119.838 no . . .
C24 C25 H25 120.664 no . . .
C26 C25 H25 120.679 no . . .
N21 C26 H26 119.231 no . . .
C25 C26 H26 119.227 no . . .
C33 C34 H34 126.733 no . . .
C35 C34 H34 126.727 no . . .
C33 C36 H36A 109.470 no . . .
C33 C36 H36B 109.474 no . . .
C33 C36 H36C 109.479 no . . .
H36A C36 H36B 109.471 no . . .
H36A C36 H36C 109.468 no . . .
H36B C36 H36C 109.465 no . . .
C35 C37 H37A 109.473 no . . .
C35 C37 H37B 109.470 no . . .
C35 C37 H37C 109.469 no . . .
H37A C37 H37B 109.467 no . . .
H37A C37 H37C 109.477 no . . .
H37B C37 H37C 109.471 no . . .
C43 C44 H44 126.625 no . . .
C45 C44 H44 126.617 no . . .
C43 C46 H46A 109.471 no . . .
C43 C46 H46B 109.468 no . . .
C43 C46 H46C 109.467 no . . .
H46A C46 H46B 109.473 no . . .
H46A C46 H46C 109.475 no . . .
H46B C46 H46C 109.473 no . . .
C45 C47 H47A 109.470 no . . .
C45 C47 H47B 109.470 no . . .
C45 C47 H47C 109.471 no . . .
H47A C47 H47B 109.468 no . . .
H47A C47 H47C 109.474 no . . .
H47B C47 H47C 109.474 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
N11 Pt1 N21 C22 -3.51(18) no . . . .
N11 Pt1 N21 C26 178.9(2) no . . . .
N21 Pt1 N11 C12 3.35(19) no . . . .
N21 Pt1 N11 C16 179.9(2) no . . . .
N11 Pt1 N41 N42 96.9(2) no . . . .
N11 Pt1 N41 C45 -87.6(3) no . . . .
N41 Pt1 N11 C12 -175.15(19) no . . . .
N41 Pt1 N11 C16 1.3(2) no . . . .
N21 Pt1 N31 N32 -97.12(19) no . . . .
N21 Pt1 N31 C35 109.0(2) no . . . .
N31 Pt1 N21 C22 174.76(19) no . . . .
N31 Pt1 N21 C26 -2.8(2) no . . . .
N31 Pt1 N41 N42 -81.3(2) no . . . .
N31 Pt1 N41 C45 94.2(3) no . . . .
N41 Pt1 N31 N32 81.27(19) no . . . .
N41 Pt1 N31 C35 -72.6(2) no . . . .
Pt1 N11 C12 C13 177.6(2) no . . . .
Pt1 N11 C12 C22 -2.6(4) no . . . .
Pt1 N11 C16 C15 -177.7(2) no . . . .
C12 N11 C16 C15 -1.3(5) no . . . .
C16 N11 C12 C13 0.8(5) no . . . .
C16 N11 C12 C22 -179.4(3) no . . . .
Pt1 N21 C22 C12 3.1(4) no . . . .
Pt1 N21 C22 C23 -177.5(2) no . . . .
Pt1 N21 C26 C25 178.0(2) no . . . .
C22 N21 C26 C25 0.5(5) no . . . .
C26 N21 C22 C12 -179.2(3) no . . . .
C26 N21 C22 C23 0.2(5) no . . . .
Pt1 N31 N32 Au1 39.3(3) no . . . .
Pt1 N31 N32 C33 -159.24(15) no . . . .
Pt1 N31 C35 C34 155.27(18) no . . . .
Pt1 N31 C35 C37 -28.4(4) no . . . .
N32 N31 C35 C34 -0.2(3) no . . . .
N32 N31 C35 C37 176.2(2) no . . . .
C35 N31 N32 Au1 -161.3(2) no . . . .
C35 N31 N32 C33 0.1(3) no . . . .
Au1 N32 C33 C34 160.31(17) no . . . .
Au1 N32 C33 C36 -19.7(4) no . . . .
N31 N32 C33 C34 0.0(3) no . . . .
N31 N32 C33 C36 -180.0(2) no . . . .
Pt1 N41 N42 Au1 -21.4(3) no . . . 2_765
Pt1 N41 N42 C43 176.54(17) no . . . .
Pt1 N41 C45 C44 -175.7(2) no . . . .
Pt1 N41 C45 C47 4.2(5) no . . . .
N42 N41 C45 C44 0.0(4) no . . . .
N42 N41 C45 C47 179.9(3) no . . . .
C45 N41 N42 Au1 162.1(2) no . . . 2_765
C45 N41 N42 C43 0.1(4) no . . . .
Au1 N42 C43 C44 -159.6(2) no 2_765 . . .
Au1 N42 C43 C46 21.1(5) no 2_765 . . .
N41 N42 C43 C44 -0.1(4) no . . . .
N41 N42 C43 C46 -179.5(3) no . . . .
N11 C12 C13 C14 0.0(5) no . . . .
N11 C12 C22 N21 -0.3(4) no . . . .
N11 C12 C22 C23 -179.7(3) no . . . .
C13 C12 C22 N21 179.5(3) no . . . .
C13 C12 C22 C23 0.1(6) no . . . .
C22 C12 C13 C14 -179.7(3) no . . . .
C12 C13 C14 C15 -0.4(6) no . . . .
C13 C14 C15 C16 -0.0(6) no . . . .
C14 C15 C16 N11 0.9(6) no . . . .
N21 C22 C23 C24 -0.1(5) no . . . .
C12 C22 C23 C24 179.3(3) no . . . .
C22 C23 C24 C25 -0.9(5) no . . . .
C23 C24 C25 C26 1.6(6) no . . . .
C24 C25 C26 N21 -1.4(6) no . . . .
N32 C33 C34 C35 -0.1(3) no . . . .
C36 C33 C34 C35 179.9(3) no . . . .
C33 C34 C35 N31 0.2(3) no . . . .
C33 C34 C35 C37 -175.8(3) no . . . .
N42 C43 C44 C45 0.2(4) no . . . .
C46 C43 C44 C45 179.4(4) no . . . .
C43 C44 C45 N41 -0.1(4) no . . . .
C43 C44 C45 C47 180.0(3) no . . . .

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
Au1 Au1 3.1064(4) no . 2_765
Au1 Pt1 3.5534(5) no . .
Au1 Pt1 3.3449(5) no . 2_765
Au1 N32 3.555(3) no . 2_765
Au1 C36 3.352(5) no . .
Au1 C46 3.452(4) no . 2_765
Pt1 C37 3.529(5) no . .
Pt1 C47 3.502(4) no . .
N11 C14 2.761(5) no . .
N21 C24 2.744(5) no . .
N31 N42 3.364(3) no . .
N31 C26 3.154(5) no . .
N32 N41 3.357(4) no . .
N32 N42 3.383(3) no . .
N41 C16 3.119(5) no . .
N41 C35 3.415(4) no . .
C12 C15 2.734(4) no . .
C13 C16 2.728(6) no . .
C13 C23 3.040(4) no . .
C22 C25 2.746(4) no . .
C23 C26 2.740(6) no . .
F1 N1 3.511(5) no . .
F1 C2 3.307(5) no . .
F1 C15 3.429(5) no . 2_666
F1 C16 3.143(4) no . 2_666
F1 C24 3.390(4) no . 1_455
F1 C45 3.468(4) no . 2_666
F1 C47 3.329(5) no . 2_666
F2 C13 3.492(5) no . 2_766
F2 C24 3.401(5) no . 1_455
F2 C37 3.504(4) no . .
F2 C47 3.405(4) no . .
F2 C47 3.470(4) no . 2_666
F3 C2 3.264(5) no . .
F3 C3 3.133(5) no . .
F3 C25 3.269(6) no . 2_756
F3 C26 3.037(5) no . 2_756
F4 C3 3.479(5) no . .
F4 C13 3.342(5) no . 2_766
F4 C36 3.293(5) no . 1_556
F5 F5 2.859(3) no . 2_756
F5 C13 3.168(5) no . 2_766
F5 C14 3.138(5) no . 2_766
F5 C37 3.332(4) no . .
F6 C14 3.224(4) no . 1_545
F6 C15 3.298(4) no . 1_545
F6 C24 3.219(4) no . 1_455
F6 C25 3.521(4) no . 1_455
F6 C37 3.492(5) no . .
N1 F1 3.511(5) no . .
N1 C2 3.549(6) no . 2_657
N1 C3 3.426(6) no . 2_657
N1 C15 3.339(5) no . 2_666
N1 C16 3.372(5) no . 2_666
N21 C13 3.577(5) no . 2_766
C2 F1 3.307(5) no . .
C2 F3 3.264(5) no . .
C2 N1 3.549(6) no . 2_657
C2 C2 3.438(6) no . 2_657
C3 F3 3.133(5) no . .
C3 F4 3.479(5) no . .
C3 N1 3.426(6) no . 2_657
C12 C22 3.591(5) no . 2_766
C13 F2 3.492(5) no . 2_766
C13 F4 3.342(5) no . 2_766
C13 F5 3.168(5) no . 2_766
C13 N21 3.577(5) no . 2_766
C14 F5 3.138(5) no . 2_766
C14 F6 3.224(4) no . 1_565
C14 C26 3.599(5) no . 2_766
C15 F1 3.429(5) no . 2_666
C15 F6 3.298(4) no . 1_565
C15 N1 3.339(5) no . 2_666
C15 C24 3.530(6) no . 2_766
C16 F1 3.143(4) no . 2_666
C16 N1 3.372(5) no . 2_666
C22 C12 3.591(5) no . 2_766
C24 F1 3.390(4) no . 1_655
C24 F2 3.401(5) no . 1_655
C24 F6 3.219(4) no . 1_655
C24 C15 3.530(6) no . 2_766
C25 F3 3.269(6) no . 2_756
C25 F6 3.521(4) no . 1_655
C26 F3 3.037(5) no . 2_756
C26 C14 3.599(5) no . 2_766
C34 C36 3.584(6) no . 2_755
C36 F4 3.293(5) no . 1_554
C36 C34 3.584(6) no . 2_755
C37 F2 3.504(4) no . .
C37 F5 3.332(4) no . .
C37 F6 3.492(5) no . .
C43 C44 3.523(6) no . 2_665
C44 C43 3.523(6) no . 2_665
C44 C46 3.494(6) no . 2_665
C45 F1 3.468(4) no . 2_666
C46 C44 3.494(6) no . 2_665
C47 F1 3.329(5) no . 2_666
C47 F2 3.405(4) no . .
C47 F2 3.470(4) no . 2_666
Au1 H26 3.5522 no . .
Au1 H36A 3.2042 no . .
Au1 H36B 3.2426 no . .
Au1 H46B 3.3865 no . 2_765
Au1 H46C 3.2940 no . 2_765
Pt1 H16 3.0915 no . .
Pt1 H26 3.0794 no . .
Pt1 H37A 2.9903 no . .
Pt1 H47A 3.0572 no . .
N1 H3A 3.0746 no . .
N1 H3B 3.0607 no . .
N1 H3C 3.0801 no . .
N11 H13 3.2397 no . .
N11 H15 3.2285 no . .
N11 H36A 3.5490 no . 2_765
N11 H36B 3.0467 no . 2_765
N11 H47A 3.3677 no . .
N21 H23 3.2446 no . .
N21 H25 3.2292 no . .
N31 H26 2.6141 no . .
N31 H34 3.1318 no . .
N31 H37A 2.5689 no . .
N31 H37B 2.9928 no . .
N31 H37C 3.1903 no . .
N32 H26 3.2073 no . .
N32 H34 3.1342 no . .
N32 H36A 2.7690 no . .
N32 H36B 2.6638 no . .
N32 H36C 3.2507 no . .
N41 H16 2.5841 no . .
N41 H37A 3.5131 no . .
N41 H44 3.1254 no . .
N41 H47A 2.5808 no . .
N41 H47B 2.9416 no . .
N41 H47C 3.2150 no . .
N42 H16 3.1402 no . .
N42 H44 3.1326 no . .
N42 H46A 3.2583 no . .
N42 H46B 2.6934 no . .
N42 H46C 2.7728 no . .
C12 H14 3.2496 no . .
C12 H16 3.1893 no . .
C12 H23 2.7304 no . .
C12 H36B 2.9905 no . 2_765
C13 H15 3.2411 no . .
C13 H23 2.7760 no . .
C13 H36B 3.2471 no . 2_765
C14 H16 3.2367 no . .
C14 H36B 3.5307 no . 2_765
C15 H13 3.2408 no . .
C15 H36A 3.2233 no . 2_765
C15 H36B 3.5596 no . 2_765
C16 H14 3.2440 no . .
C16 H36A 3.1807 no . 2_765
C16 H36B 3.3114 no . 2_765
C16 H47A 3.4074 no . .
C22 H13 2.7263 no . .
C22 H24 3.2444 no . .
C22 H26 3.1955 no . .
C23 H13 2.7697 no . .
C23 H25 3.2568 no . .
C24 H26 3.2310 no . .
C24 H46B 3.3647 no . 2_765
C25 H23 3.2563 no . .
C25 H46B 3.1905 no . 2_765
C25 H46C 3.3703 no . 2_765
C26 H24 3.2347 no . .
C26 H46B 3.3120 no . 2_765
C26 H46C 3.4918 no . 2_765
C34 H36A 3.1664 no . .
C34 H36B 3.2462 no . .
C34 H36C 2.7246 no . .
C34 H37A 3.3577 no . .
C34 H37B 2.9748 no . .
C34 H37C 2.8204 no . .
C35 H26 3.2757 no . .
C35 H47B 3.5566 no . .
C36 H34 2.9432 no . .
C37 H34 2.9423 no . .
C37 H47A 3.5947 no . .
C37 H47B 2.9603 no . .
C44 H46A 2.7135 no . .
C44 H46B 3.2373 no . .
C44 H46C 3.1819 no . .
C44 H47A 3.3235 no . .
C44 H47B 3.0369 no . .
C44 H47C 2.7735 no . .
C45 H16 2.9416 no . .
C45 H37A 3.5757 no . .
C46 H44 2.9351 no . .
C47 H16 3.4271 no . .
C47 H37A 3.0139 no . .
C47 H37C 3.5162 no . .
C47 H44 2.9404 no . .
H13 H14 2.3382 no . .
H13 H23 2.2326 no . .
H14 H15 2.3408 no . .
H15 H16 2.3214 no . .
H15 H36A 3.4988 no . 2_765
H16 H36A 3.4177 no . 2_765
H16 H47A 3.0520 no . .
H23 H24 2.3395 no . .
H24 H25 2.3367 no . .
H25 H26 2.3293 no . .
H25 H46B 3.5138 no . 2_765
H25 H46C 3.3012 no . 2_765
H26 H37B 3.5413 no . .
H26 H46C 3.4814 no . 2_765
H34 H36A 3.5172 no . .
H34 H36C 2.7296 no . .
H34 H37B 3.1910 no . .
H34 H37C 2.8889 no . .
H37A H47A 2.7833 no . .
H37A H47B 2.5023 no . .
H37C H47B 2.6678 no . .
H44 H46A 2.7074 no . .
H44 H46C 3.5310 no . .
H44 H47B 3.2931 no . .
H44 H47C 2.8221 no . .
P1 H13 3.3658 no . 2_766
P1 H14 3.3003 no . 1_545
P1 H24 3.0871 no . 1_455
P1 H47C 3.3873 no . 2_666
F1 H3C 3.2683 no . .
F1 H15 3.1006 no . 2_666
F1 H16 2.5336 no . 2_666
F1 H24 2.6555 no . 1_455
F1 H47A 3.2333 no . 2_666
F1 H47C 2.8669 no . 2_666
F2 H13 2.6391 no . 2_766
F2 H23 2.8618 no . 2_766
F2 H24 2.4728 no . 1_455
F2 H37A 2.8473 no . .
F2 H37C 3.4499 no . .
F2 H47A 3.0161 no . .
F2 H47A 3.4670 no . 2_666
F2 H47B 3.0157 no . .
F2 H47C 2.6452 no . 2_666
F3 H3A 2.6122 no . .
F3 H3C 3.1357 no . .
F3 H14 2.8913 no . 1_545
F3 H25 2.9242 no . 2_756
F3 H26 2.4615 no . 2_756
F3 H37B 3.0566 no . 2_756
F4 H3A 3.3397 no . .
F4 H3C 2.8286 no . .
F4 H13 3.0010 no . 2_766
F4 H36B 3.0519 no . 1_556
F4 H36C 2.6492 no . 1_556
F4 H44 3.2348 no . 2_666
F4 H47C 2.8505 no . 2_666
F5 H13 2.6881 no . 2_766
F5 H14 2.6927 no . 1_545
F5 H14 2.6330 no . 2_766
F5 H37A 3.0303 no . .
F5 H37B 2.9089 no . .
F5 H37B 2.9242 no . 2_756
F5 H37C 3.5501 no . .
F6 H14 2.5678 no . 1_545
F6 H15 2.7211 no . 1_545
F6 H24 2.4402 no . 1_455
F6 H25 3.0735 no . 1_455
F6 H25 3.5541 no . 2_756
F6 H37A 3.4498 no . .
F6 H37B 3.4035 no . .
F6 H37C 3.0570 no . .
N1 H3B 2.5887 no . 2_657
N1 H15 2.8423 no . 2_666
N1 H16 2.8862 no . 2_666
N1 H25 3.0106 no . 2_756
N1 H36A 3.2097 no . 1_456
N1 H46C 2.7556 no . 1_546
N11 H23 3.5524 no . 2_766
N21 H13 3.5846 no . 2_766
N31 H3A 3.2780 no . 2_756
N32 H3A 3.1780 no . 2_756
C2 H3B 3.1546 no . 2_657
C2 H16 3.2890 no . 2_666
C2 H25 3.2994 no . 2_756
C2 H26 3.3406 no . 2_756
C2 H46C 3.0463 no . 1_546
C2 H46C 3.5171 no . 2_666
C3 H26 3.3202 no . 2_756
C3 H34 2.9414 no . 1_556
C3 H36A 3.5607 no . 2_756
C3 H36C 3.5229 no . 1_556
C3 H46C 3.3533 no . 2_666
C23 H47A 3.2736 no . 2_766
C23 H47B 3.4240 no . 1_655
C23 H47C 3.1133 no . 1_655
C24 H47B 3.0508 no . 1_655
C24 H47C 3.4117 no . 1_655
C26 H3A 3.4401 no . 2_756
C26 H14 3.5155 no . 2_766
C33 H3A 3.1459 no . 2_756
C33 H3B 3.4415 no . 2_756
C33 H34 3.1472 no . 2_755
C34 H3A 3.2339 no . 2_756
C34 H3B 3.3719 no . 1_554
C34 H3C 3.3457 no . 1_554
C34 H34 3.1603 no . 2_755
C34 H36A 3.4649 no . 2_755
C34 H36C 3.0431 no . 2_755
C34 H46A 3.1657 no . 2_665
C35 H3A 3.3095 no . 2_756
C35 H36C 3.5213 no . 2_755
C35 H46A 3.1948 no . 2_665
C36 H3B 3.4903 no . 2_756
C36 H34 2.9148 no . 2_755
C37 H46A 3.3865 no . 2_665
C43 H3C 3.1622 no . 2_666
C43 H44 3.2716 no . 2_665
C44 H3C 2.9134 no . 2_666
C44 H46A 3.2736 no . 2_665
C44 H46B 3.1916 no . 2_665
C45 H46A 3.2144 no . 2_665
C45 H46B 3.3764 no . 2_665
C46 H3B 3.4616 no . 2_666
C46 H3C 3.3786 no . 2_666
C46 H37C 3.5091 no . 2_665
C46 H44 3.3424 no . 2_665
C46 H47B 3.2757 no . 2_665
C47 H23 3.5019 no . 1_455
C47 H23 3.4173 no . 2_766
C47 H24 3.3994 no . 1_455
C47 H46A 3.4751 no . 2_665
C47 H46B 3.3500 no . 2_665
H3A F3 2.6122 no . .
H3A F4 3.3397 no . .
H3A N31 3.2780 no . 2_756
H3A N32 3.1780 no . 2_756
H3A C26 3.4401 no . 2_756
H3A C33 3.1459 no . 2_756
H3A C34 3.2339 no . 2_756
H3A C35 3.3095 no . 2_756
H3A H26 2.5356 no . 2_756
H3A H34 3.0952 no . 1_556
H3A H36A 3.4830 no . 2_756
H3A H36C 3.2303 no . 1_556
H3B N1 2.5887 no . 2_657
H3B C2 3.1546 no . 2_657
H3B C33 3.4415 no . 2_756
H3B C34 3.3719 no . 1_556
H3B C36 3.4903 no . 2_756
H3B C46 3.4616 no . 2_666
H3B H34 2.5075 no . 1_556
H3B H36A 2.7841 no . 2_756
H3B H46A 3.2959 no . 2_666
H3B H46C 2.9202 no . 2_666
H3C F1 3.2683 no . .
H3C F3 3.1357 no . .
H3C F4 2.8286 no . .
H3C C34 3.3457 no . 1_556
H3C C43 3.1622 no . 2_666
H3C C44 2.9134 no . 2_666
H3C C46 3.3786 no . 2_666
H3C H34 2.7520 no . 1_556
H3C H36C 2.9956 no . 1_556
H3C H44 2.7215 no . 2_666
H3C H46A 3.2072 no . 2_666
H3C H46C 3.1996 no . 2_666
H13 P1 3.3658 no . 2_766
H13 F2 2.6391 no . 2_766
H13 F4 3.0010 no . 2_766
H13 F5 2.6881 no . 2_766
H13 N21 3.5846 no . 2_766
H13 H37A 2.9820 no . 2_766
H13 H47A 3.4724 no . 2_766
H14 P1 3.3003 no . 1_565
H14 F3 2.8913 no . 1_565
H14 F5 2.6927 no . 1_565
H14 F5 2.6330 no . 2_766
H14 F6 2.5678 no . 1_565
H14 C26 3.5155 no . 2_766
H14 H37B 3.1859 no . 1_565
H14 H37B 3.5881 no . 2_766
H15 F1 3.1006 no . 2_666
H15 F6 2.7211 no . 1_565
H15 N1 2.8423 no . 2_666
H15 H25 3.0041 no . 1_465
H15 H37C 3.5784 no . 1_565
H16 F1 2.5336 no . 2_666
H16 N1 2.8862 no . 2_666
H16 C2 3.2890 no . 2_666
H23 F2 2.8618 no . 2_766
H23 N11 3.5524 no . 2_766
H23 C47 3.5019 no . 1_655
H23 C47 3.4173 no . 2_766
H23 H47A 2.5009 no . 2_766
H23 H47B 3.4177 no . 1_655
H23 H47C 2.7757 no . 1_655
H24 P1 3.0871 no . 1_655
H24 F1 2.6555 no . 1_655
H24 F2 2.4728 no . 1_655
H24 F6 2.4402 no . 1_655
H24 C47 3.3994 no . 1_655
H24 H37C 3.5526 no . 1_655
H24 H47A 3.4383 no . 2_766
H24 H47B 2.7367 no . 1_655
H24 H47C 3.3007 no . 1_655
H25 F3 2.9242 no . 2_756
H25 F6 3.0735 no . 1_655
H25 F6 3.5541 no . 2_756
H25 N1 3.0106 no . 2_756
H25 C2 3.2994 no . 2_756
H25 H15 3.0041 no . 1_645
H26 F3 2.4615 no . 2_756
H26 C2 3.3406 no . 2_756
H26 C3 3.3202 no . 2_756
H26 H3A 2.5356 no . 2_756
H34 C3 2.9414 no . 1_554
H34 C33 3.1472 no . 2_755
H34 C34 3.1603 no . 2_755
H34 C36 2.9148 no . 2_755
H34 H3A 3.0952 no . 1_554
H34 H3B 2.5075 no . 1_554
H34 H3C 2.7520 no . 1_554
H34 H34 2.8981 no . 2_755
H34 H36A 2.6778 no . 2_755
H34 H36C 2.5965 no . 2_755
H34 H46A 3.1157 no . 2_665
H36A N1 3.2097 no . 1_654
H36A C3 3.5607 no . 2_756
H36A C34 3.4649 no . 2_755
H36A H3A 3.4830 no . 2_756
H36A H3B 2.7841 no . 2_756
H36A H34 2.6778 no . 2_755
H36B F4 3.0519 no . 1_554
H36B H44 3.4322 no . 2_665
H36C F4 2.6492 no . 1_554
H36C C3 3.5229 no . 1_554
H36C C34 3.0431 no . 2_755
H36C C35 3.5213 no . 2_755
H36C H3A 3.2303 no . 1_554
H36C H3C 2.9956 no . 1_554
H36C H34 2.5965 no . 2_755
H36C H37B 3.1253 no . 2_755
H37A F2 2.8473 no . .
H37A F5 3.0303 no . .
H37A F6 3.4498 no . .
H37A H13 2.9820 no . 2_766
H37B F3 3.0566 no . 2_756
H37B F5 2.9089 no . .
H37B F5 2.9242 no . 2_756
H37B F6 3.4035 no . .
H37B H14 3.1859 no . 1_545
H37B H14 3.5881 no . 2_766
H37B H36C 3.1253 no . 2_755
H37C F2 3.4499 no . .
H37C F5 3.5501 no . .
H37C F6 3.0570 no . .
H37C C46 3.5091 no . 2_665
H37C H15 3.5784 no . 1_545
H37C H24 3.5526 no . 1_455
H37C H46A 2.7816 no . 2_665
H37C H46C 3.5688 no . 2_665
H44 F4 3.2348 no . 2_666
H44 C43 3.2716 no . 2_665
H44 C46 3.3424 no . 2_665
H44 H3C 2.7215 no . 2_666
H44 H36B 3.4322 no . 2_665
H44 H46A 3.3940 no . 2_665
H44 H46B 2.8775 no . 2_665
H46A C34 3.1657 no . 2_665
H46A C35 3.1948 no . 2_665
H46A C37 3.3865 no . 2_665
H46A C44 3.2736 no . 2_665
H46A C45 3.2144 no . 2_665
H46A C47 3.4751 no . 2_665
H46A H3B 3.2959 no . 2_666
H46A H3C 3.2072 no . 2_666
H46A H34 3.1157 no . 2_665
H46A H37C 2.7816 no . 2_665
H46A H44 3.3940 no . 2_665
H46A H47B 2.8491 no . 2_665
H46B C44 3.1916 no . 2_665
H46B C45 3.3764 no . 2_665
H46B C47 3.3500 no . 2_665
H46B H44 2.8775 no . 2_665
H46B H47B 2.8112 no . 2_665
H46B H47C 3.4219 no . 2_665
H46C N1 2.7556 no . 1_564
H46C C2 3.0463 no . 1_564
H46C C2 3.5171 no . 2_666
H46C C3 3.3533 no . 2_666
H46C H3B 2.9202 no . 2_666
H46C H3C 3.1996 no . 2_666
H46C H37C 3.5688 no . 2_665
H47A F1 3.2333 no . 2_666
H47A F2 3.0161 no . .
H47A F2 3.4670 no . 2_666
H47A C23 3.2736 no . 2_766
H47A H13 3.4724 no . 2_766
H47A H23 2.5009 no . 2_766
H47A H24 3.4383 no . 2_766
H47B F2 3.0157 no . .
H47B C23 3.4240 no . 1_455
H47B C24 3.0508 no . 1_455
H47B C46 3.2757 no . 2_665
H47B H23 3.4177 no . 1_455
H47B H24 2.7367 no . 1_455
H47B H46A 2.8491 no . 2_665
H47B H46B 2.8112 no . 2_665
H47C P1 3.3873 no . 2_666
H47C F1 2.8669 no . 2_666
H47C F2 2.6452 no . 2_666
H47C F4 2.8505 no . 2_666
H47C C23 3.1133 no . 1_455
H47C C24 3.4117 no . 1_455
H47C H23 2.7757 no . 1_455
H47C H24 3.3007 no . 1_455
H47C H46B 3.4219 no . 2_665

#==============================================================================
#     End of CIF
#==============================================================================






_chemical_name_systematic        '[Pt2Au2(bpy)2(Me2pz)4](PF6)2'
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: acetonitrile/diethyl ether'
_exptl_crystal_preparation       Luminescent
