data_03src0571
 
#Prof. D. Bruce

#The alkyl chains were slightly disordered. One could be modelled over
#two sites 

_audit_creation_method            SHELXL-97
_chemical_name_systematic
;
 ?
;
_chemical_name_common             ?
_chemical_melting_point           ?
_chemical_formula_moiety          'C32 H40 F5 N O4 Pt'
_chemical_formula_sum
 'C32 H40 F5 N O4 Pt'
_chemical_formula_weight          792.74
 
loop_
 _atom_type_symbol
 _atom_type_description
 _atom_type_scat_dispersion_real
 _atom_type_scat_dispersion_imag
 _atom_type_scat_source
 'C'  'C'   0.0033   0.0016
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'H'  'H'   0.0000   0.0000
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'N'  'N'   0.0061   0.0033
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'O'  'O'   0.0106   0.0060
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'F'  'F'   0.0171   0.0103
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'Pt'  'Pt'  -1.7033   8.3905
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 
_symmetry_cell_setting            Monoclinic
_symmetry_space_group_name_H-M    P2(1)/c
_symmetry_space_group_name_hall   '-P 2ybc'
 
loop_
 _symmetry_equiv_pos_as_xyz
 'x, y, z'
 '-x, y+1/2, -z+1/2'
 '-x, -y, -z'
 'x, -y-1/2, z-1/2'
 
_cell_length_a                    18.6505(3)
_cell_length_b                    10.5350(2)
_cell_length_c                    33.7505(7)
_cell_angle_alpha                 90.00
_cell_angle_beta                  96.9940(10)
_cell_angle_gamma                 90.00
_cell_volume                      6582.1(2)
_cell_formula_units_Z             8
_cell_measurement_temperature     120(2)
_cell_measurement_reflns_used     14154
_cell_measurement_theta_min       2.910
_cell_measurement_theta_max       27.485
 
_exptl_crystal_description        Blade
_exptl_crystal_colour             Orange
_exptl_crystal_size_max           0.16
_exptl_crystal_size_mid           0.08
_exptl_crystal_size_min           0.03
_exptl_crystal_density_meas       ?
_exptl_crystal_density_diffrn     1.600
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000              3152
_exptl_absorpt_coefficient_mu     4.327
_exptl_absorpt_correction_type    multi-scan
_exptl_absorpt_correction_T_min   0.5444
_exptl_absorpt_correction_T_max   0.8812
_exptl_absorpt_process_details       'SADABS 2007/2 (Sheldrick, G.M., 2007)'

_exptl_special_details
;
SADABS was used to perform the Absorption correction
Estimated minimum and maximum transmission: 0.6173 0.7456
The given Tmin and Tmax were generated using the SHELX SIZE command
;
 
_diffrn_ambient_temperature       120(2)
_diffrn_radiation_wavelength      0.71073
_diffrn_radiation_type            MoK\a 
_diffrn_radiation_source          'Nonius FR591 rotating anode'
_diffrn_radiation_monochromator   graphite 
_diffrn_measurement_device_type   'Nonius KappaCCD Area Detector'
_diffrn_measurement_method        'φ and ω scans to fill Ewald Sphere'
_diffrn_detector_area_resol_mean  9.091
_diffrn_standards_number          ?
_diffrn_standards_interval_count  ?
_diffrn_standards_interval_time   ?
_diffrn_standards_decay_%         ?
_diffrn_reflns_number             57990
_diffrn_reflns_av_R_equivalents   0.1225
_diffrn_reflns_av_sigmaI/netI     0.1520
_diffrn_reflns_limit_h_min        -24
_diffrn_reflns_limit_h_max        24
_diffrn_reflns_limit_k_min        -13
_diffrn_reflns_limit_k_max        13
_diffrn_reflns_limit_l_min        -43
_diffrn_reflns_limit_l_max        43
_diffrn_reflns_theta_min          2.94
_diffrn_reflns_theta_max          27.48
_reflns_number_total              14999
_reflns_number_gt                 9064
_reflns_threshold_expression      >2sigma(I)
 
_computing_data_collection        
'COLLECT (Hooft, R.W.W., 1998)'
_computing_cell_refinement        
'DENZO (Otwinowski & Minor, 1997) & COLLECT (Hooft, R.W.W., 1998)'
#Although determined using DirAx, the cell is refined in the HKL
#package during data reduction
_computing_data_reduction         
'DENZO (Otwinowski & Minor, 1997) & COLLECT (Hooft, R.W.W., 1998)' 
_computing_structure_solution     'SHELXS-97 (Sheldrick, 1997a)' 
_computing_structure_refinement   'SHELXL-97 (Sheldrick, 1997b)' 
_computing_molecular_graphics     'ORTEP3 for Windows (Farrugia, 1997)'
_computing_publication_material   'WinGX (Farrugia, 1999)'
 
_refine_special_details
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;
 
_refine_ls_structure_factor_coef  Fsqd
_refine_ls_matrix_type            full
_refine_ls_weighting_scheme       calc
_refine_ls_weighting_details
 'calc w=1/[σ²(Fo²)+(0.0050P)²+53.4903P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary      direct
_atom_sites_solution_secondary    difmap
_atom_sites_solution_hydrogens    geom
_refine_ls_hydrogen_treatment     constr
_refine_ls_extinction_method      none
_refine_ls_extinction_coef        ?
_refine_ls_number_reflns          14999
_refine_ls_number_parameters      807
_refine_ls_number_restraints      401
_refine_ls_R_factor_all           0.1487
_refine_ls_R_factor_gt            0.0887
_refine_ls_wR_factor_ref          0.1577
_refine_ls_wR_factor_gt           0.1311
_refine_ls_goodness_of_fit_ref    1.059
_refine_ls_restrained_S_all       1.046
_refine_ls_shift/su_max           0.001
_refine_ls_shift/su_mean          0.000
 
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
C1 C 0.1148(5) 0.1851(8) 0.4705(3) 0.027(2) Uani 1 1 d . . .
C2 C 0.1876(5) 0.1712(8) 0.4826(3) 0.028(2) Uani 1 1 d . . .
H2 H 0.2214 0.1934 0.4649 0.034 Uiso 1 1 calc R . .
C3 C 0.2124(5) 0.1251(8) 0.5205(3) 0.029(2) Uani 1 1 d . A .
C4 C 0.1642(5) 0.0948(8) 0.5472(3) 0.032(2) Uani 1 1 d . . .
H4 H 0.1815 0.0642 0.5731 0.038 Uiso 1 1 calc R . .
C5 C 0.0912(5) 0.1093(8) 0.5362(3) 0.032(2) Uani 1 1 d . . .
H5 H 0.0583 0.0895 0.5546 0.038 Uiso 1 1 calc R . .
C6 C 0.0655(6) 0.1521(8) 0.4986(3) 0.033(2) Uani 1 1 d . . .
C7 C -0.0086(5) 0.1628(8) 0.4827(3) 0.028(2) Uani 1 1 d . . .
H7 H -0.0465 0.1433 0.4982 0.034 Uiso 1 1 calc R . .
C8 C -0.0952(5) 0.2029(8) 0.4265(3) 0.026(2) Uani 1 1 d . . .
C9 C -0.1095(5) 0.1586(8) 0.3874(3) 0.032(2) Uani 1 1 d . . .
H9 H -0.0710 0.1278 0.3740 0.039 Uiso 1 1 calc R . .
C10 C -0.1795(6) 0.1591(9) 0.3676(3) 0.037(3) Uani 1 1 d . . .
H10 H -0.1892 0.1276 0.3411 0.044 Uiso 1 1 calc R . .
C11 C -0.2350(5) 0.2065(9) 0.3873(3) 0.035(3) Uani 1 1 d . . .
C12 C -0.2209(6) 0.2491(9) 0.4266(3) 0.035(2) Uani 1 1 d . . .
H12 H -0.2592 0.2795 0.4401 0.042 Uiso 1 1 calc R . .
C13 C -0.1513(5) 0.2473(8) 0.4458(3) 0.032(2) Uani 1 1 d . . .
H13 H -0.1419 0.2768 0.4726 0.039 Uiso 1 1 calc R . .
C14 C 0.3133(8) 0.057(4) 0.5660(6) 0.049(6) Uani 0.597(11) 1 d PDU A 1
H14A H 0.2843 -0.0193 0.5706 0.059 Uiso 0.597(11) 1 calc PR A 1
H14B H 0.3093 0.1175 0.5880 0.059 Uiso 0.597(11) 1 calc PR A 1
C15 C 0.3912(8) 0.0195(15) 0.5654(7) 0.053(4) Uani 0.597(11) 1 d PDU A 1
H15A H 0.3946 -0.0384 0.5426 0.063 Uiso 0.597(11) 1 calc PR A 1
H15B H 0.4078 -0.0276 0.5902 0.063 Uiso 0.597(11) 1 calc PR A 1
C16 C 0.4409(8) 0.1316(17) 0.5620(7) 0.063(4) Uani 0.597(11) 1 d PDU A 1
H16A H 0.4379 0.1893 0.5849 0.075 Uiso 0.597(11) 1 calc PR A 1
H16B H 0.4242 0.1791 0.5373 0.075 Uiso 0.597(11) 1 calc PR A 1
C17 C 0.5195(8) 0.093(2) 0.5612(9) 0.080(5) Uani 0.597(11) 1 d PDU A 1
H17A H 0.5341 0.0372 0.5845 0.096 Uiso 0.597(11) 1 calc PR A 1
H17B H 0.5228 0.0418 0.5369 0.096 Uiso 0.597(11) 1 calc PR A 1
C18 C 0.5722(9) 0.201(2) 0.5620(9) 0.092(6) Uani 0.597(11) 1 d PDU A 1
H18A H 0.5705 0.2511 0.5868 0.110 Uiso 0.597(11) 1 calc PR A 1
H18B H 0.5577 0.2580 0.5390 0.110 Uiso 0.597(11) 1 calc PR A 1
C19 C 0.6503(9) 0.154(3) 0.5602(16) 0.106(11) Uani 0.597(11) 1 d PDU A 1
H19A H 0.6607 0.0832 0.5786 0.159 Uiso 0.597(11) 1 calc PR A 1
H19B H 0.6843 0.2238 0.5678 0.159 Uiso 0.597(11) 1 calc PR A 1
H19C H 0.6555 0.1267 0.5329 0.159 Uiso 0.597(11) 1 calc PR A 1
C114 C 0.3157(11) 0.082(6) 0.5686(7) 0.048(7) Uani 0.403(11) 1 d PDU A 2
H14C H 0.3014 -0.0049 0.5751 0.058 Uiso 0.403(11) 1 calc PR A 2
H14D H 0.2970 0.1417 0.5877 0.058 Uiso 0.403(11) 1 calc PR A 2
C115 C 0.3969(11) 0.092(3) 0.5718(9) 0.053(4) Uani 0.403(11) 1 d PDU A 2
H15C H 0.4176 0.0725 0.5995 0.063 Uiso 0.403(11) 1 calc PR A 2
H15D H 0.4104 0.1803 0.5660 0.063 Uiso 0.403(11) 1 calc PR A 2
C116 C 0.4298(11) 0.003(3) 0.5437(9) 0.063(4) Uani 0.403(11) 1 d PDU A 2
H16C H 0.4170 0.0335 0.5159 0.075 Uiso 0.403(11) 1 calc PR A 2
H16D H 0.4086 -0.0823 0.5457 0.075 Uiso 0.403(11) 1 calc PR A 2
C117 C 0.5118(11) -0.007(3) 0.5523(11) 0.080(5) Uani 0.403(11) 1 d PDU A 2
H17C H 0.5240 -0.0416 0.5795 0.096 Uiso 0.403(11) 1 calc PR A 2
H17D H 0.5288 -0.0683 0.5333 0.096 Uiso 0.403(11) 1 calc PR A 2
C118 C 0.5528(14) 0.116(3) 0.5494(14) 0.092(6) Uani 0.403(11) 1 d PDU A 2
H18C H 0.5414 0.1740 0.5708 0.110 Uiso 0.403(11) 1 calc PR A 2
H18D H 0.5370 0.1565 0.5234 0.110 Uiso 0.403(11) 1 calc PR A 2
C119 C 0.6356(13) 0.093(5) 0.553(3) 0.106(11) Uani 0.403(11) 1 d PDU A 2
H19D H 0.6525 0.0645 0.5806 0.159 Uiso 0.403(11) 1 calc PR A 2
H19E H 0.6600 0.1727 0.5481 0.159 Uiso 0.403(11) 1 calc PR A 2
H19F H 0.6465 0.0284 0.5343 0.159 Uiso 0.403(11) 1 calc PR A 2
C20 C -0.3231(5) 0.1757(10) 0.3301(3) 0.044(3) Uani 1 1 d DU . .
H20A H -0.3116 0.0846 0.3272 0.053 Uiso 1 1 calc R . .
H20B H -0.2947 0.2255 0.3126 0.053 Uiso 1 1 calc R . .
C21 C -0.4027(5) 0.1982(9) 0.3186(4) 0.049(3) Uani 1 1 d DU . .
H21A H -0.4297 0.1553 0.3383 0.058 Uiso 1 1 calc R . .
H21B H -0.4174 0.1588 0.2922 0.058 Uiso 1 1 calc R . .
C22 C -0.4236(5) 0.3372(9) 0.3165(4) 0.042(3) Uani 1 1 d DU . .
H22A H -0.3938 0.3823 0.2986 0.050 Uiso 1 1 calc R . .
H22B H -0.4136 0.3753 0.3434 0.050 Uiso 1 1 calc R . .
C23 C -0.5037(5) 0.3551(9) 0.3010(3) 0.043(3) Uani 1 1 d DU . .
H23A H -0.5139 0.3121 0.2749 0.051 Uiso 1 1 calc R . .
H23B H -0.5332 0.3131 0.3197 0.051 Uiso 1 1 calc R . .
C24 C -0.5273(5) 0.4932(9) 0.2962(4) 0.048(3) Uani 1 1 d DU . .
H24A H -0.4989 0.5347 0.2769 0.057 Uiso 1 1 calc R . .
H24B H -0.5161 0.5369 0.3221 0.057 Uiso 1 1 calc R . .
C25 C -0.6078(6) 0.5096(11) 0.2817(4) 0.063(4) Uani 1 1 d DU . .
H25A H -0.6188 0.4715 0.2552 0.095 Uiso 1 1 calc R . .
H25B H -0.6197 0.6002 0.2803 0.095 Uiso 1 1 calc R . .
H25C H -0.6364 0.4675 0.3004 0.095 Uiso 1 1 calc R . .
C31 C 0.2673(6) 0.2070(11) 0.3496(4) 0.047(3) Uani 1 1 d U . .
C32 C 0.2339(6) 0.3408(10) 0.3514(3) 0.037(2) Uani 1 1 d U . .
C33 C 0.1571(5) 0.3404(8) 0.3616(3) 0.028(2) Uani 1 1 d . . .
C34 C 0.1035(5) 0.3884(9) 0.3361(3) 0.034(3) Uani 1 1 d . . .
H34 H 0.1161 0.4252 0.3122 0.041 Uiso 1 1 calc R . .
C35 C 0.0284(5) 0.3889(8) 0.3417(3) 0.025(2) Uani 1 1 d . . .
C36 C -0.0239(5) 0.4564(9) 0.3120(3) 0.035(3) Uani 1 1 d . . .
H36A H -0.0124 0.4349 0.2850 0.042 Uiso 1 1 calc R . .
H36B H -0.0164 0.5489 0.3157 0.042 Uiso 1 1 calc R . .
C37 C -0.1034(5) 0.4280(10) 0.3137(3) 0.040(3) Uani 1 1 d . . .
H37A H -0.1132 0.3388 0.3069 0.060 Uiso 1 1 calc R . .
H37B H -0.1330 0.4825 0.2947 0.060 Uiso 1 1 calc R . .
H37C H -0.1154 0.4445 0.3407 0.060 Uiso 1 1 calc R . .
N1 N -0.0218(4) 0.2011(7) 0.4457(3) 0.0283(19) Uani 1 1 d . . .
O1 O 0.2861(4) 0.1140(7) 0.5285(2) 0.0393(18) Uani 1 1 d DU . .
O2 O -0.3060(4) 0.2144(6) 0.3706(2) 0.0403(18) Uani 1 1 d U . .
O31 O 0.1553(3) 0.2890(6) 0.3971(2) 0.0332(17) Uani 1 1 d . . .
O32 O 0.0026(3) 0.3343(6) 0.3701(2) 0.0302(16) Uani 1 1 d . . .
F31 F 0.3294(3) 0.2113(6) 0.3346(2) 0.0590(19) Uani 1 1 d U . .
F32 F 0.2815(4) 0.1581(8) 0.3862(3) 0.089(3) Uani 1 1 d U . .
F33 F 0.2231(4) 0.1315(6) 0.3277(3) 0.083(3) Uani 1 1 d U . .
F34 F 0.2779(3) 0.4106(6) 0.3773(2) 0.0586(19) Uani 1 1 d U . .
F35 F 0.2375(3) 0.3914(6) 0.31464(19) 0.0487(16) Uani 1 1 d U . .
Pt1 Pt 0.06386(2) 0.24978(3) 0.419484(12) 0.02729(11) Uani 1 1 d . . .
C41 C -0.0637(5) 0.9622(9) 0.3065(3) 0.036(3) Uani 1 1 d . . .
C42 C -0.1159(5) 1.0071(8) 0.2774(3) 0.029(2) Uani 1 1 d . . .
H42 H -0.1617 0.9667 0.2735 0.035 Uiso 1 1 calc R . .
C43 C -0.1027(5) 1.1102(8) 0.2538(3) 0.031(2) Uani 1 1 d . . .
C44 C -0.0330(5) 1.1662(9) 0.2575(3) 0.030(2) Uani 1 1 d . . .
H44 H -0.0229 1.2340 0.2404 0.036 Uiso 1 1 calc R . .
C45 C 0.0197(5) 1.1206(9) 0.2861(3) 0.033(2) Uani 1 1 d . . .
H45 H 0.0667 1.1569 0.2889 0.040 Uiso 1 1 calc R . .
C46 C 0.0043(5) 1.0213(8) 0.3112(3) 0.029(2) Uani 1 1 d . . .
C47 C 0.0541(5) 0.9699(8) 0.3424(3) 0.031(2) Uani 1 1 d . . .
H47 H 0.1017 1.0027 0.3483 0.037 Uiso 1 1 calc R . .
C48 C 0.0773(5) 0.8145(9) 0.3941(3) 0.032(2) Uani 1 1 d . . .
C49 C 0.0806(5) 0.6839(9) 0.3955(3) 0.032(2) Uani 1 1 d . . .
H49 H 0.0491 0.6352 0.3772 0.038 Uiso 1 1 calc R . .
C50 C 0.1296(5) 0.6226(9) 0.4235(3) 0.035(3) Uani 1 1 d . . .
H50 H 0.1320 0.5325 0.4242 0.041 Uiso 1 1 calc R . .
C51 C 0.1746(5) 0.6935(9) 0.4503(3) 0.035(3) Uani 1 1 d . . .
C52 C 0.1700(5) 0.8255(9) 0.4500(3) 0.029(2) Uani 1 1 d . . .
H52 H 0.1997 0.8741 0.4693 0.035 Uiso 1 1 calc R . .
C53 C 0.1222(5) 0.8852(9) 0.4217(3) 0.028(2) Uani 1 1 d . . .
H53 H 0.1199 0.9752 0.4209 0.033 Uiso 1 1 calc R . .
C54 C -0.1496(5) 1.2517(9) 0.2010(3) 0.035(2) Uani 1 1 d DU . .
H54A H -0.1122 1.2307 0.1837 0.042 Uiso 1 1 calc R . .
H54B H -0.1343 1.3288 0.2166 0.042 Uiso 1 1 calc R . .
C55 C -0.2209(5) 1.2738(10) 0.1763(3) 0.041(3) Uani 1 1 d DU . .
H55A H -0.2376 1.1931 0.1632 0.050 Uiso 1 1 calc R . .
H55B H -0.2143 1.3360 0.1551 0.050 Uiso 1 1 calc R . .
C56 C -0.2787(5) 1.3225(10) 0.2004(3) 0.047(3) Uani 1 1 d DU . .
H56A H -0.2633 1.4057 0.2121 0.056 Uiso 1 1 calc R . .
H56B H -0.2830 1.2630 0.2227 0.056 Uiso 1 1 calc R . .
C57 C -0.3524(5) 1.3375(11) 0.1763(3) 0.047(3) Uani 1 1 d DU . .
H57A H -0.3489 1.4007 0.1549 0.056 Uiso 1 1 calc R . .
H57B H -0.3669 1.2554 0.1634 0.056 Uiso 1 1 calc R . .
C58 C -0.4102(6) 1.3794(11) 0.2014(4) 0.055(3) Uani 1 1 d DU . .
H58A H -0.3976 1.4647 0.2124 0.065 Uiso 1 1 calc R . .
H58B H -0.4106 1.3201 0.2241 0.065 Uiso 1 1 calc R . .
C59 C -0.4857(6) 1.3842(12) 0.1782(4) 0.069(4) Uani 1 1 d DU . .
H59A H -0.4871 1.4495 0.1575 0.103 Uiso 1 1 calc R . .
H59B H -0.5210 1.4046 0.1965 0.103 Uiso 1 1 calc R . .
H59C H -0.4973 1.3014 0.1658 0.103 Uiso 1 1 calc R . .
C60 C 0.2438(6) 0.5104(9) 0.4769(3) 0.045(3) Uani 1 1 d DU . .
H60A H 0.2629 0.4926 0.4514 0.054 Uiso 1 1 calc R . .
H60B H 0.2006 0.4567 0.4784 0.054 Uiso 1 1 calc R . .
C61 C 0.3002(5) 0.4820(9) 0.5114(3) 0.046(3) Uani 1 1 d DU . .
H61A H 0.3135 0.3911 0.5106 0.055 Uiso 1 1 calc R . .
H61B H 0.2796 0.4974 0.5366 0.055 Uiso 1 1 calc R . .
C62 C 0.3682(5) 0.5625(11) 0.5110(3) 0.053(3) Uani 1 1 d DU . .
H62A H 0.3547 0.6534 0.5099 0.063 Uiso 1 1 calc R . .
H62B H 0.3911 0.5425 0.4868 0.063 Uiso 1 1 calc R . .
C63 C 0.4230(6) 0.5387(12) 0.5482(4) 0.065(4) Uani 1 1 d DU . .
H63A H 0.3992 0.5534 0.5725 0.078 Uiso 1 1 calc R . .
H63B H 0.4388 0.4490 0.5484 0.078 Uiso 1 1 calc R . .
C64 C 0.4892(6) 0.6253(14) 0.5492(4) 0.079(4) Uani 1 1 d DU . .
H64A H 0.5117 0.6124 0.5244 0.095 Uiso 1 1 calc R . .
H64B H 0.4731 0.7148 0.5496 0.095 Uiso 1 1 calc R . .
C65 C 0.5459(8) 0.602(2) 0.5850(5) 0.136(8) Uani 1 1 d DU . .
H65A H 0.5562 0.5111 0.5874 0.204 Uiso 1 1 calc R . .
H65B H 0.5277 0.6326 0.6093 0.204 Uiso 1 1 calc R . .
H65C H 0.5903 0.6480 0.5812 0.204 Uiso 1 1 calc R . .
C71 C -0.3021(7) 0.6687(12) 0.2798(4) 0.052(3) Uani 1 1 d U . .
C72 C -0.2965(5) 0.7303(9) 0.3215(4) 0.037(2) Uani 1 1 d U . .
C73 C -0.2202(5) 0.7290(9) 0.3443(3) 0.031(2) Uani 1 1 d . . .
C74 C -0.2047(5) 0.6573(9) 0.3770(3) 0.033(2) Uani 1 1 d . . .
H74 H -0.2433 0.6091 0.3853 0.039 Uiso 1 1 calc R . .
C75 C -0.1365(5) 0.6458(8) 0.4006(3) 0.030(2) Uani 1 1 d . . .
C76 C -0.1329(5) 0.5701(9) 0.4384(3) 0.036(3) Uani 1 1 d . . .
H76A H -0.1616 0.4916 0.4330 0.043 Uiso 1 1 calc R . .
H76B H -0.1554 0.6199 0.4585 0.043 Uiso 1 1 calc R . .
C77 C -0.0569(5) 0.5337(9) 0.4560(4) 0.042(3) Uani 1 1 d . . .
H77A H -0.0368 0.4732 0.4383 0.063 Uiso 1 1 calc R . .
H77B H -0.0584 0.4945 0.4823 0.063 Uiso 1 1 calc R . .
H77C H -0.0265 0.6098 0.4589 0.063 Uiso 1 1 calc R . .
N41 N 0.0307(4) 0.8736(7) 0.3628(2) 0.0266(19) Uani 1 1 d . . .
O41 O -0.1591(4) 1.1479(6) 0.2274(2) 0.0354(17) Uani 1 1 d U . .
O42 O 0.2248(4) 0.6437(6) 0.4791(2) 0.0393(18) Uani 1 1 d U . .
O71 O -0.1777(3) 0.8014(6) 0.3264(2) 0.0327(16) Uani 1 1 d . . .
O72 O -0.0789(3) 0.6949(5) 0.3914(2) 0.0280(15) Uani 1 1 d . . .
F71 F -0.2649(4) 0.7326(10) 0.2567(2) 0.099(3) Uani 1 1 d U . .
F72 F -0.3706(3) 0.6670(7) 0.2638(2) 0.0615(19) Uani 1 1 d U . .
F73 F -0.2793(4) 0.5509(8) 0.2833(3) 0.084(3) Uani 1 1 d U . .
F74 F -0.3430(3) 0.6681(6) 0.3419(2) 0.0550(18) Uani 1 1 d U . .
F75 F -0.3199(3) 0.8502(6) 0.3173(2) 0.062(2) Uani 1 1 d U . .
Pt2 Pt -0.07314(2) 0.82770(3) 0.346329(12) 0.02857(11) Uani 1 1 d . . .
 
 
_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
 
loop_
 _geom_bond_atom_site_label_1
 _geom_bond_atom_site_label_2
 _geom_bond_distance
 _geom_bond_site_symmetry_2
 _geom_bond_publ_flag
C1 C2 1.376(12) . ?
C1 C6 1.443(13) . ?
C1 Pt1 1.983(10) . ?
C2 C3 1.392(13) . ?
C2 H2 0.9500 . ?
C3 O1 1.372(11) . ?
C3 C4 1.388(13) . ?
C4 C5 1.375(13) . ?
C4 H4 0.9500 . ?
C5 C6 1.375(14) . ?
C5 H5 0.9500 . ?
C6 C7 1.426(13) . ?
C7 N1 1.308(12) . ?
C7 H7 0.9500 . ?
C8 C13 1.381(13) . ?
C8 C9 1.396(14) . ?
C8 N1 1.441(11) . ?
C9 C10 1.392(13) . ?
C9 H9 0.9500 . ?
C10 C11 1.388(14) . ?
C10 H10 0.9500 . ?
C11 O2 1.376(11) . ?
C11 C12 1.396(14) . ?
C12 C13 1.378(13) . ?
C12 H12 0.9500 . ?
C13 H13 0.9500 . ?
C14 O1 1.437(14) . ?
C14 C15 1.508(13) . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C15 C16 1.514(13) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C16 C17 1.525(14) . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C17 C18 1.507(16) . ?
C17 H17A 0.9900 . ?
C17 H17B 0.9900 . ?
C18 C19 1.548(14) . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C114 O1 1.437(15) . ?
C114 C115 1.510(16) . ?
C114 H14C 0.9900 . ?
C114 H14D 0.9900 . ?
C115 C116 1.514(16) . ?
C115 H15C 0.9900 . ?
C115 H15D 0.9900 . ?
C116 C117 1.524(16) . ?
C116 H16C 0.9900 . ?
C116 H16D 0.9900 . ?
C117 C118 1.508(18) . ?
C117 H17C 0.9900 . ?
C117 H17D 0.9900 . ?
C118 C119 1.551(16) . ?
C118 H18C 0.9900 . ?
C118 H18D 0.9900 . ?
C119 H19D 0.9800 . ?
C119 H19E 0.9800 . ?
C119 H19F 0.9800 . ?
C20 O2 1.428(12) . ?
C20 C21 1.506(11) . ?
C20 H20A 0.9900 . ?
C20 H20B 0.9900 . ?
C21 C22 1.516(11) . ?
C21 H21A 0.9900 . ?
C21 H21B 0.9900 . ?
C22 C23 1.534(11) . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C23 C24 1.522(11) . ?
C23 H23A 0.9900 . ?
C23 H23B 0.9900 . ?
C24 C25 1.530(12) . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
C31 F33 1.309(13) . ?
C31 F31 1.322(11) . ?
C31 F32 1.335(14) . ?
C31 C32 1.546(14) . ?
C32 F34 1.344(11) . ?
C32 F35 1.359(12) . ?
C32 C33 1.513(14) . ?
C33 O31 1.319(11) . ?
C33 C34 1.337(13) . ?
C34 C35 1.436(13) . ?
C34 H34 0.9500 . ?
C35 O32 1.262(11) . ?
C35 C36 1.491(13) . ?
C36 C37 1.520(13) . ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 0.9800 . ?
N1 Pt1 1.986(8) . ?
O31 Pt1 1.992(7) . ?
O32 Pt1 2.101(6) . ?
C41 C42 1.379(13) . ?
C41 C46 1.403(13) . ?
C41 Pt2 1.976(11) . ?
C42 C43 1.386(13) . ?
C42 H42 0.9500 . ?
C43 O41 1.352(11) . ?
C43 C44 1.419(13) . ?
C44 C45 1.380(13) . ?
C44 H44 0.9500 . ?
C45 C46 1.398(13) . ?
C45 H45 0.9500 . ?
C46 C47 1.424(14) . ?
C47 N41 1.329(12) . ?
C47 H47 0.9500 . ?
C48 C49 1.378(12) . ?
C48 C53 1.390(13) . ?
C48 N41 1.427(12) . ?
C49 C50 1.392(13) . ?
C49 H49 0.9500 . ?
C50 C51 1.376(14) . ?
C50 H50 0.9500 . ?
C51 O42 1.370(12) . ?
C51 C52 1.393(12) . ?
C52 C53 1.378(13) . ?
C52 H52 0.9500 . ?
C53 H53 0.9500 . ?
C54 O41 1.434(11) . ?
C54 C55 1.500(11) . ?
C54 H54A 0.9900 . ?
C54 H54B 0.9900 . ?
C55 C56 1.516(12) . ?
C55 H55A 0.9900 . ?
C55 H55B 0.9900 . ?
C56 C57 1.517(11) . ?
C56 H56A 0.9900 . ?
C56 H56B 0.9900 . ?
C57 C58 1.515(12) . ?
C57 H57A 0.9900 . ?
C57 H57B 0.9900 . ?
C58 C59 1.526(12) . ?
C58 H58A 0.9900 . ?
C58 H58B 0.9900 . ?
C59 H59A 0.9800 . ?
C59 H59B 0.9800 . ?
C59 H59C 0.9800 . ?
C60 O42 1.453(11) . ?
C60 C61 1.501(11) . ?
C60 H60A 0.9900 . ?
C60 H60B 0.9900 . ?
C61 C62 1.527(12) . ?
C61 H61A 0.9900 . ?
C61 H61B 0.9900 . ?
C62 C63 1.538(12) . ?
C62 H62A 0.9900 . ?
C62 H62B 0.9900 . ?
C63 C64 1.532(13) . ?
C63 H63A 0.9900 . ?
C63 H63B 0.9900 . ?
C64 C65 1.524(13) . ?
C64 H64A 0.9900 . ?
C64 H64B 0.9900 . ?
C65 H65A 0.9800 . ?
C65 H65B 0.9800 . ?
C65 H65C 0.9800 . ?
C71 F71 1.294(14) . ?
C71 F73 1.312(13) . ?
C71 F72 1.326(12) . ?
C71 C72 1.542(17) . ?
C72 F75 1.339(11) . ?
C72 F74 1.340(11) . ?
C72 C73 1.533(13) . ?
C73 O71 1.302(11) . ?
C73 C74 1.340(13) . ?
C74 C75 1.421(13) . ?
C74 H74 0.9500 . ?
C75 O72 1.265(11) . ?
C75 C76 1.498(14) . ?
C76 C77 1.517(13) . ?
C76 H76A 0.9900 . ?
C76 H76B 0.9900 . ?
C77 H77A 0.9800 . ?
C77 H77B 0.9800 . ?
C77 H77C 0.9800 . ?
N41 Pt2 2.008(7) . ?
O71 Pt2 2.004(6) . ?
O72 Pt2 2.080(6) . ?
 
loop_
 _geom_angle_atom_site_label_1
 _geom_angle_atom_site_label_2
 _geom_angle_atom_site_label_3
 _geom_angle
 _geom_angle_site_symmetry_1
 _geom_angle_site_symmetry_3
 _geom_angle_publ_flag
C2 C1 C6 117.5(9) . . ?
C2 C1 Pt1 130.2(7) . . ?
C6 C1 Pt1 112.2(7) . . ?
C1 C2 C3 121.1(9) . . ?
C1 C2 H2 119.5 . . ?
C3 C2 H2 119.5 . . ?
O1 C3 C4 124.3(9) . . ?
O1 C3 C2 115.1(9) . . ?
C4 C3 C2 120.5(9) . . ?
C5 C4 C3 119.7(10) . . ?
C5 C4 H4 120.1 . . ?
C3 C4 H4 120.1 . . ?
C6 C5 C4 120.6(10) . . ?
C6 C5 H5 119.7 . . ?
C4 C5 H5 119.7 . . ?
C5 C6 C7 125.8(10) . . ?
C5 C6 C1 120.5(10) . . ?
C7 C6 C1 113.6(9) . . ?
N1 C7 C6 116.4(9) . . ?
N1 C7 H7 121.8 . . ?
C6 C7 H7 121.8 . . ?
C13 C8 C9 119.4(9) . . ?
C13 C8 N1 121.7(9) . . ?
C9 C8 N1 118.9(8) . . ?
C10 C9 C8 120.9(9) . . ?
C10 C9 H9 119.6 . . ?
C8 C9 H9 119.6 . . ?
C11 C10 C9 118.9(10) . . ?
C11 C10 H10 120.6 . . ?
C9 C10 H10 120.6 . . ?
O2 C11 C10 124.2(10) . . ?
O2 C11 C12 115.4(9) . . ?
C10 C11 C12 120.3(10) . . ?
C13 C12 C11 120.1(9) . . ?
C13 C12 H12 120.0 . . ?
C11 C12 H12 120.0 . . ?
C12 C13 C8 120.5(10) . . ?
C12 C13 H13 119.8 . . ?
C8 C13 H13 119.8 . . ?
O1 C14 C15 109.6(14) . . ?
O1 C14 H14A 109.7 . . ?
C15 C14 H14A 109.7 . . ?
O1 C14 H14B 109.7 . . ?
C15 C14 H14B 109.7 . . ?
H14A C14 H14B 108.2 . . ?
C14 C15 C16 113.4(17) . . ?
C14 C15 H15A 108.9 . . ?
C16 C15 H15A 108.9 . . ?
C14 C15 H15B 108.9 . . ?
C16 C15 H15B 108.9 . . ?
H15A C15 H15B 107.7 . . ?
C15 C16 C17 112.9(12) . . ?
C15 C16 H16A 109.0 . . ?
C17 C16 H16A 109.0 . . ?
C15 C16 H16B 109.0 . . ?
C17 C16 H16B 109.0 . . ?
H16A C16 H16B 107.8 . . ?
C18 C17 C16 114.9(14) . . ?
C18 C17 H17A 108.5 . . ?
C16 C17 H17A 108.5 . . ?
C18 C17 H17B 108.5 . . ?
C16 C17 H17B 108.5 . . ?
H17A C17 H17B 107.5 . . ?
C17 C18 C19 111.9(15) . . ?
C17 C18 H18A 109.2 . . ?
C19 C18 H18A 109.2 . . ?
C17 C18 H18B 109.2 . . ?
C19 C18 H18B 109.2 . . ?
H18A C18 H18B 107.9 . . ?
O1 C114 C115 108.6(18) . . ?
O1 C114 H14C 110.0 . . ?
C115 C114 H14C 110.0 . . ?
O1 C114 H14D 110.0 . . ?
C115 C114 H14D 110.0 . . ?
H14C C114 H14D 108.3 . . ?
C114 C115 C116 113(2) . . ?
C114 C115 H15C 108.9 . . ?
C116 C115 H15C 108.9 . . ?
C114 C115 H15D 108.9 . . ?
C116 C115 H15D 108.9 . . ?
H15C C115 H15D 107.7 . . ?
C115 C116 C117 113.4(16) . . ?
C115 C116 H16C 108.9 . . ?
C117 C116 H16C 108.9 . . ?
C115 C116 H16D 108.9 . . ?
C117 C116 H16D 108.9 . . ?
H16C C116 H16D 107.7 . . ?
C118 C117 C116 115.7(17) . . ?
C118 C117 H17C 108.4 . . ?
C116 C117 H17C 108.4 . . ?
C118 C117 H17D 108.4 . . ?
C116 C117 H17D 108.4 . . ?
H17C C117 H17D 107.4 . . ?
C117 C118 C119 111.8(19) . . ?
C117 C118 H18C 109.3 . . ?
C119 C118 H18C 109.3 . . ?
C117 C118 H18D 109.3 . . ?
C119 C118 H18D 109.3 . . ?
H18C C118 H18D 107.9 . . ?
C118 C119 H19D 109.5 . . ?
C118 C119 H19E 109.5 . . ?
C118 C119 H19F 109.5 . . ?
H19D C119 H19F 109.5 . . ?
O2 C20 C21 107.5(9) . . ?
O2 C20 H20A 110.2 . . ?
C21 C20 H20A 110.2 . . ?
O2 C20 H20B 110.2 . . ?
C21 C20 H20B 110.2 . . ?
H20A C20 H20B 108.5 . . ?
C20 C21 C22 113.8(8) . . ?
C20 C21 H21A 108.8 . . ?
C22 C21 H21A 108.8 . . ?
C20 C21 H21B 108.8 . . ?
C22 C21 H21B 108.8 . . ?
H21A C21 H21B 107.7 . . ?
C21 C22 C23 111.7(8) . . ?
C21 C22 H22A 109.3 . . ?
C23 C22 H22A 109.3 . . ?
C21 C22 H22B 109.3 . . ?
C23 C22 H22B 109.3 . . ?
H22A C22 H22B 107.9 . . ?
C24 C23 C22 114.3(8) . . ?
C24 C23 H23A 108.7 . . ?
C22 C23 H23A 108.7 . . ?
C24 C23 H23B 108.7 . . ?
C22 C23 H23B 108.7 . . ?
H23A C23 H23B 107.6 . . ?
C23 C24 C25 113.7(9) . . ?
C23 C24 H24A 108.8 . . ?
C25 C24 H24A 108.8 . . ?
C23 C24 H24B 108.8 . . ?
C25 C24 H24B 108.8 . . ?
H24A C24 H24B 107.7 . . ?
C24 C25 H25A 109.5 . . ?
C24 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
C24 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
F33 C31 F31 109.0(11) . . ?
F33 C31 F32 109.3(10) . . ?
F31 C31 F32 106.5(10) . . ?
F33 C31 C32 110.3(9) . . ?
F31 C31 C32 111.1(9) . . ?
F32 C31 C32 110.6(10) . . ?
F34 C32 F35 106.6(8) . . ?
F34 C32 C33 112.0(9) . . ?
F35 C32 C33 111.2(9) . . ?
F34 C32 C31 107.9(9) . . ?
F35 C32 C31 104.9(9) . . ?
C33 C32 C31 113.8(8) . . ?
O31 C33 C34 129.9(10) . . ?
O31 C33 C32 109.6(8) . . ?
C34 C33 C32 120.4(10) . . ?
C33 C34 C35 125.5(10) . . ?
C33 C34 H34 117.3 . . ?
C35 C34 H34 117.3 . . ?
O32 C35 C34 124.6(9) . . ?
O32 C35 C36 116.6(8) . . ?
C34 C35 C36 118.8(9) . . ?
C35 C36 C37 116.3(9) . . ?
C35 C36 H36A 108.2 . . ?
C37 C36 H36A 108.2 . . ?
C35 C36 H36B 108.2 . . ?
C37 C36 H36B 108.2 . . ?
H36A C36 H36B 107.4 . . ?
C36 C37 H37A 109.5 . . ?
C36 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
C36 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
C7 N1 C8 119.4(8) . . ?
C7 N1 Pt1 116.0(7) . . ?
C8 N1 Pt1 124.6(6) . . ?
C3 O1 C14 116.6(9) . . ?
C3 O1 C114 117.9(11) . . ?
C11 O2 C20 117.8(8) . . ?
C33 O31 Pt1 123.2(6) . . ?
C35 O32 Pt1 125.1(6) . . ?
C1 Pt1 N1 81.4(4) . . ?
C1 Pt1 O31 93.4(3) . . ?
N1 Pt1 O31 174.6(3) . . ?
C1 Pt1 O32 172.5(3) . . ?
N1 Pt1 O32 94.2(3) . . ?
O31 Pt1 O32 91.1(3) . . ?
C42 C41 C46 118.6(10) . . ?
C42 C41 Pt2 128.1(8) . . ?
C46 C41 Pt2 113.3(8) . . ?
C41 C42 C43 121.2(9) . . ?
C41 C42 H42 119.4 . . ?
C43 C42 H42 119.4 . . ?
O41 C43 C42 115.5(9) . . ?
O41 C43 C44 124.4(9) . . ?
C42 C43 C44 120.0(9) . . ?
C45 C44 C43 118.9(9) . . ?
C45 C44 H44 120.6 . . ?
C43 C44 H44 120.6 . . ?
C44 C45 C46 120.2(9) . . ?
C44 C45 H45 119.9 . . ?
C46 C45 H45 119.9 . . ?
C45 C46 C41 120.9(9) . . ?
C45 C46 C47 124.6(9) . . ?
C41 C46 C47 114.5(9) . . ?
N41 C47 C46 116.5(9) . . ?
N41 C47 H47 121.7 . . ?
C46 C47 H47 121.7 . . ?
C49 C48 C53 119.4(9) . . ?
C49 C48 N41 118.9(9) . . ?
C53 C48 N41 121.7(8) . . ?
C48 C49 C50 120.7(9) . . ?
C48 C49 H49 119.7 . . ?
C50 C49 H49 119.7 . . ?
C51 C50 C49 119.4(9) . . ?
C51 C50 H50 120.3 . . ?
C49 C50 H50 120.3 . . ?
O42 C51 C50 124.6(9) . . ?
O42 C51 C52 115.0(9) . . ?
C50 C51 C52 120.4(9) . . ?
C53 C52 C51 119.6(9) . . ?
C53 C52 H52 120.2 . . ?
C51 C52 H52 120.2 . . ?
C52 C53 C48 120.5(8) . . ?
C52 C53 H53 119.8 . . ?
C48 C53 H53 119.8 . . ?
O41 C54 C55 107.2(8) . . ?
O41 C54 H54A 110.3 . . ?
C55 C54 H54A 110.3 . . ?
O41 C54 H54B 110.3 . . ?
C55 C54 H54B 110.3 . . ?
H54A C54 H54B 108.5 . . ?
C54 C55 C56 113.2(9) . . ?
C54 C55 H55A 108.9 . . ?
C56 C55 H55A 108.9 . . ?
C54 C55 H55B 108.9 . . ?
C56 C55 H55B 108.9 . . ?
H55A C55 H55B 107.7 . . ?
C55 C56 C57 113.8(9) . . ?
C55 C56 H56A 108.8 . . ?
C57 C56 H56A 108.8 . . ?
C55 C56 H56B 108.8 . . ?
C57 C56 H56B 108.8 . . ?
H56A C56 H56B 107.7 . . ?
C58 C57 C56 112.9(9) . . ?
C58 C57 H57A 109.0 . . ?
C56 C57 H57A 109.0 . . ?
C58 C57 H57B 109.0 . . ?
C56 C57 H57B 109.0 . . ?
H57A C57 H57B 107.8 . . ?
C57 C58 C59 113.4(10) . . ?
C57 C58 H58A 108.9 . . ?
C59 C58 H58A 108.9 . . ?
C57 C58 H58B 108.9 . . ?
C59 C58 H58B 108.9 . . ?
H58A C58 H58B 107.7 . . ?
C58 C59 H59A 109.5 . . ?
C58 C59 H59B 109.5 . . ?
H59A C59 H59B 109.5 . . ?
C58 C59 H59C 109.5 . . ?
H59A C59 H59C 109.5 . . ?
H59B C59 H59C 109.5 . . ?
O42 C60 C61 107.7(8) . . ?
O42 C60 H60A 110.2 . . ?
C61 C60 H60A 110.2 . . ?
O42 C60 H60B 110.2 . . ?
C61 C60 H60B 110.2 . . ?
H60A C60 H60B 108.5 . . ?
C60 C61 C62 112.9(9) . . ?
C60 C61 H61A 109.0 . . ?
C62 C61 H61A 109.0 . . ?
C60 C61 H61B 109.0 . . ?
C62 C61 H61B 109.0 . . ?
H61A C61 H61B 107.8 . . ?
C61 C62 C63 111.9(9) . . ?
C61 C62 H62A 109.2 . . ?
C63 C62 H62A 109.2 . . ?
C61 C62 H62B 109.2 . . ?
C63 C62 H62B 109.2 . . ?
H62A C62 H62B 107.9 . . ?
C64 C63 C62 112.0(10) . . ?
C64 C63 H63A 109.2 . . ?
C62 C63 H63A 109.2 . . ?
C64 C63 H63B 109.2 . . ?
C62 C63 H63B 109.2 . . ?
H63A C63 H63B 107.9 . . ?
C65 C64 C63 113.7(12) . . ?
C65 C64 H64A 108.8 . . ?
C63 C64 H64A 108.8 . . ?
C65 C64 H64B 108.8 . . ?
C63 C64 H64B 108.8 . . ?
H64A C64 H64B 107.7 . . ?
C64 C65 H65A 109.5 . . ?
C64 C65 H65B 109.5 . . ?
H65A C65 H65B 109.5 . . ?
C64 C65 H65C 109.5 . . ?
H65A C65 H65C 109.5 . . ?
H65B C65 H65C 109.5 . . ?
F71 C71 F73 110.8(12) . . ?
F71 C71 F72 108.8(11) . . ?
F73 C71 F72 108.0(10) . . ?
F71 C71 C72 110.6(10) . . ?
F73 C71 C72 109.3(10) . . ?
F72 C71 C72 109.4(10) . . ?
F75 C72 F74 107.1(8) . . ?
F75 C72 C73 109.4(8) . . ?
F74 C72 C73 110.9(9) . . ?
F75 C72 C71 108.3(9) . . ?
F74 C72 C71 106.7(9) . . ?
C73 C72 C71 114.2(9) . . ?
O71 C73 C74 129.1(9) . . ?
O71 C73 C72 110.0(9) . . ?
C74 C73 C72 120.9(9) . . ?
C73 C74 C75 126.9(9) . . ?
C73 C74 H74 116.6 . . ?
C75 C74 H74 116.6 . . ?
O72 C75 C74 123.7(9) . . ?
O72 C75 C76 118.4(9) . . ?
C74 C75 C76 117.9(8) . . ?
C75 C76 C77 114.3(8) . . ?
C75 C76 H76A 108.7 . . ?
C77 C76 H76A 108.7 . . ?
C75 C76 H76B 108.7 . . ?
C77 C76 H76B 108.7 . . ?
H76A C76 H76B 107.6 . . ?
C76 C77 H77A 109.5 . . ?
C76 C77 H77B 109.5 . . ?
H77A C77 H77B 109.5 . . ?
C76 C77 H77C 109.5 . . ?
H77A C77 H77C 109.5 . . ?
H77B C77 H77C 109.5 . . ?
C47 N41 C48 120.5(8) . . ?
C47 N41 Pt2 114.0(7) . . ?
C48 N41 Pt2 125.4(6) . . ?
C43 O41 C54 119.2(7) . . ?
C51 O42 C60 118.9(7) . . ?
C73 O71 Pt2 123.2(6) . . ?
C75 O72 Pt2 125.2(6) . . ?
C41 Pt2 O71 92.0(3) . . ?
C41 Pt2 N41 81.5(4) . . ?
O71 Pt2 N41 173.2(3) . . ?
C41 Pt2 O72 175.7(3) . . ?
O71 Pt2 O72 91.0(3) . . ?
N41 Pt2 O72 95.4(3) . . ?
 
_diffrn_measured_fraction_theta_max    0.993
_diffrn_reflns_theta_full              27.48
_diffrn_measured_fraction_theta_full   0.993
_refine_diff_density_max    1.969
_refine_diff_density_min   -1.946
_refine_diff_density_rms    0.222
