#------------------------------------------------------------------------------
#$Date: 2016-03-21 08:28:38 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178607 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/18/4071818.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4071818
loop_
_publ_author_name
'Moret, Marc-Etienne'
'Chen, Peter'
_publ_section_title
;
 Mononuclear Organometallic Platinum(II) Complexes and
 Platinum(II)−Copper(I) Mixed Complexes from Symmetrical
 3,5-Bis(iminoacetyl)pyrazolate Ligands
;
_journal_issue                   19
_journal_name_full               Organometallics
_journal_page_first              4903
_journal_paper_doi               10.1021/om800403y
_journal_volume                  27
_journal_year                    2008
_chemical_formula_moiety         'C72 H74 Cu2 N8 Pt2,  1.5(C4 H8 O2)'
_chemical_formula_sum            'C78 H86 Cu2 N8 O3 Pt2'
_chemical_formula_weight         1700.81
_chemical_name_systematic
;                                                                              
 ?                                                                             
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 108.050(11)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   19.7025(13)
_cell_length_b                   13.3495(12)
_cell_length_c                   28.314(2)
_cell_measurement_reflns_used    52421
_cell_measurement_temperature    220(2)
_cell_measurement_theta_max      27.50
_cell_measurement_theta_min      2.66
_cell_volume                     7080.6(10)
_computing_cell_refinement       'HKL Scalepack (Otwinowski & Minor 1997)'
_computing_data_collection       'Kappa CCD'
_computing_data_reduction        'Denzo + Scalepak (Otwinowski & Minor, 1997)'
_computing_molecular_graphics    'ORTEP (Johnson,1976)'
_computing_publication_material  SHELXL97
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SIR97 (Altomare et Al., 1997)'
_diffrn_ambient_temperature      220(2)
_diffrn_measured_fraction_theta_full .998
_diffrn_measured_fraction_theta_max .998
_diffrn_measurement_device_type  'Kappa CCD'
_diffrn_measurement_method       CCD
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0402
_diffrn_reflns_av_sigmaI/netI    0.0606
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_limit_l_min       -36
_diffrn_reflns_number            27193
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         2.66
_exptl_absorpt_coefficient_mu    4.585
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.595
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'Cut fragment'
_exptl_crystal_F_000             3392
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.14
_refine_diff_density_max         1.178
_refine_diff_density_min         -1.021
_refine_diff_density_rms         .131
_refine_ls_extinction_coef       0.00015(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL97
_refine_ls_goodness_of_fit_ref   0.987
_refine_ls_hydrogen_treatment    riding
_refine_ls_matrix_type           full
_refine_ls_number_parameters     853
_refine_ls_number_reflns         16238
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.987
_refine_ls_R_factor_all          0.0648
_refine_ls_R_factor_gt           0.0419
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0532P)²+6.7417P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0952
_refine_ls_wR_factor_ref         0.1071
_reflns_number_gt                12448
_reflns_number_total             16238
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om800403y_si_001.cif
_cod_data_source_block           moret23_ch_08
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        7080.7(10)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4071818
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'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Pt1 Pt 0.247623(10) 0.930473(15) 0.348330(6) 0.02892(6) Uani 1 1 d .
Pt2 Pt 0.197764(10) 0.591452(15) 0.413913(6) 0.02738(6) Uani 1 1 d .
Cu1 Cu 0.22934(3) 0.74954(5) 0.37303(2) 0.03724(16) Uani 1 1 d .
Cu2 Cu 0.25612(3) 0.64675(5) 0.29607(2) 0.03878(17) Uani 1 1 d .
N7 N 0.2825(2) 0.5413(3) 0.38843(14) 0.0293(9) Uani 1 1 d .
N8 N 0.3052(2) 0.5547(3) 0.34838(14) 0.0338(10) Uani 1 1 d .
N9 N 0.2176(2) 0.7695(3) 0.26102(13) 0.0299(9) Uani 1 1 d .
N10 N 0.2121(2) 0.8611(3) 0.27860(13) 0.0300(9) Uani 1 1 d .
N13 N 0.1806(2) 1.0391(3) 0.30313(15) 0.0339(10) Uani 1 1 d .
N26 N 0.2117(2) 0.5992(4) 0.20849(15) 0.0360(10) Uani 1 1 d .
N41 N 0.2615(2) 0.5104(3) 0.47489(14) 0.0299(9) Uani 1 1 d .
C1 C 0.1340(3) 0.6608(4) 0.35229(17) 0.0326(12) Uani 1 1 d .
C2 C 0.0977(3) 0.7520(5) 0.3521(2) 0.0391(13) Uani 1 1 d .
H2 H 0.1054 0.7876 0.3820 0.047 Uiso 1 1 calc R
C3 C 0.0505(3) 0.7903(5) 0.3083(2) 0.0524(16) Uani 1 1 d .
H3 H 0.0280 0.8522 0.3088 0.063 Uiso 1 1 calc R
C4 C 0.0367(3) 0.7375(6) 0.2644(2) 0.058(2) Uani 1 1 d .
H4 H 0.0044 0.7630 0.2351 0.069 Uiso 1 1 calc R
C5 C 0.0706(3) 0.6470(6) 0.2637(2) 0.0548(18) Uani 1 1 d .
H5 H 0.0608 0.6105 0.2340 0.066 Uiso 1 1 calc R
C6 C 0.1190(3) 0.6103(5) 0.30661(19) 0.0418(14) Uani 1 1 d .
H6 H 0.1426 0.5497 0.3053 0.050 Uiso 1 1 calc R
C11 C 0.1648(3) 0.9151(4) 0.24235(18) 0.0312(11) Uani 1 1 d .
C12 C 0.1507(3) 1.0169(4) 0.25672(18) 0.0347(12) Uani 1 1 d .
C14 C 0.1727(3) 1.1371(4) 0.32131(19) 0.0374(12) Uani 1 1 d .
C15 C 0.2202(3) 1.2124(5) 0.3182(2) 0.0485(15) Uani 1 1 d .
C16 C 0.2126(4) 1.3058(6) 0.3375(2) 0.068(2) Uani 1 1 d .
H16 H 0.2432 1.3585 0.3352 0.082 Uiso 1 1 calc R
C17 C 0.1613(4) 1.3221(6) 0.3598(2) 0.067(2) Uani 1 1 d .
H17 H 0.1569 1.3859 0.3726 0.081 Uiso 1 1 calc R
C18 C 0.1158(4) 1.2464(6) 0.3639(2) 0.0602(19) Uani 1 1 d .
H18 H 0.0809 1.2588 0.3795 0.072 Uiso 1 1 calc R
C19 C 0.1214(3) 1.1522(5) 0.34508(19) 0.0441(15) Uani 1 1 d .
C20 C 0.0732(3) 1.0669(5) 0.3498(2) 0.0581(18) Uani 1 1 d .
H20A H 0.0442 1.0458 0.3169 0.087 Uiso 1 1 calc R
H20B H 0.0424 1.0891 0.3686 0.087 Uiso 1 1 calc R
H20C H 0.1021 1.0111 0.3667 0.087 Uiso 1 1 calc R
C21 C 0.2769(4) 1.1935(6) 0.2946(3) 0.070(2) Uani 1 1 d .
H21A H 0.3076 1.1395 0.3120 0.106 Uiso 1 1 calc R
H21B H 0.3052 1.2538 0.2964 0.106 Uiso 1 1 calc R
H21C H 0.2550 1.1749 0.2601 0.106 Uiso 1 1 calc R
C22 C 0.1057(3) 1.0890(5) 0.2192(2) 0.0485(16) Uani 1 1 d .
H22A H 0.1120 1.1561 0.2331 0.073 Uiso 1 1 calc R
H22B H 0.0559 1.0699 0.2109 0.073 Uiso 1 1 calc R
H22C H 0.1203 1.0877 0.1895 0.073 Uiso 1 1 calc R
C23 C 0.1395(3) 0.8568(4) 0.19934(17) 0.0333(12) Uani 1 1 d .
C24 C 0.1744(3) 0.7659(4) 0.21277(17) 0.0327(11) Uani 1 1 d .
C25 C 0.1756(3) 0.6728(4) 0.18546(18) 0.0369(12) Uani 1 1 d .
C27 C 0.2236(3) 0.5126(4) 0.18231(18) 0.0393(13) Uani 1 1 d .
C28 C 0.1905(3) 0.4223(5) 0.1856(2) 0.0466(15) Uani 1 1 d .
C29 C 0.2076(4) 0.3383(6) 0.1618(3) 0.0666(19) Uani 1 1 d .
H29 H 0.1859 0.2764 0.1637 0.080 Uiso 1 1 calc R
C30 C 0.2551(5) 0.3452(6) 0.1361(3) 0.077(2) Uani 1 1 d .
H30 H 0.2657 0.2882 0.1202 0.093 Uiso 1 1 calc R
C31 C 0.2870(4) 0.4327(6) 0.1330(3) 0.070(2) Uani 1 1 d .
H31 H 0.3205 0.4353 0.1156 0.084 Uiso 1 1 calc R
C32 C 0.2718(4) 0.5198(5) 0.1550(2) 0.0571(17) Uani 1 1 d .
C33 C 0.3072(5) 0.6168(7) 0.1494(3) 0.084(3) Uani 1 1 d .
H33A H 0.3116 0.6589 0.1781 0.126 Uiso 1 1 calc R
H33B H 0.2786 0.6509 0.1196 0.126 Uiso 1 1 calc R
H33C H 0.3543 0.6032 0.1467 0.126 Uiso 1 1 calc R
C34 C 0.1367(4) 0.4158(6) 0.2137(3) 0.072(2) Uani 1 1 d .
H34A H 0.1555 0.4495 0.2454 0.108 Uiso 1 1 calc R
H34B H 0.1277 0.3460 0.2192 0.108 Uiso 1 1 calc R
H34C H 0.0925 0.4477 0.1945 0.108 Uiso 1 1 calc R
C35 C 0.1326(4) 0.6703(6) 0.1305(2) 0.076(2) Uani 1 1 d .
H35A H 0.1389 0.6058 0.1166 0.114 Uiso 1 1 calc R
H35B H 0.1491 0.7230 0.1132 0.114 Uiso 1 1 calc R
H35C H 0.0825 0.6804 0.1268 0.114 Uiso 1 1 calc R
C36 C 0.0820(3) 0.8845(5) 0.15132(19) 0.0480(15) Uani 1 1 d .
H36A H 0.0993 0.8717 0.1234 0.072 Uiso 1 1 calc R
H36B H 0.0703 0.9549 0.1520 0.072 Uiso 1 1 calc R
H36C H 0.0396 0.8445 0.1480 0.072 Uiso 1 1 calc R
C37 C 0.3692(3) 0.5066(4) 0.35766(17) 0.0312(11) Uani 1 1 d .
C38 C 0.3883(3) 0.4608(4) 0.40449(18) 0.0320(11) Uani 1 1 d .
C39 C 0.3311(3) 0.4851(4) 0.42195(17) 0.0293(11) Uani 1 1 d .
C40 C 0.3177(3) 0.4671(4) 0.46919(17) 0.0296(11) Uani 1 1 d .
C42 C 0.2465(3) 0.5012(4) 0.52174(17) 0.0327(12) Uani 1 1 d .
C43 C 0.2746(3) 0.5731(5) 0.5579(2) 0.0447(15) Uani 1 1 d .
C44 C 0.2572(4) 0.5647(6) 0.6022(2) 0.059(2) Uani 1 1 d .
H44 H 0.2743 0.6132 0.6271 0.070 Uiso 1 1 calc R
C45 C 0.2159(4) 0.4879(7) 0.6102(2) 0.065(2) Uani 1 1 d .
H45 H 0.2064 0.4826 0.6406 0.078 Uiso 1 1 calc R
C46 C 0.1886(3) 0.4189(6) 0.5733(2) 0.058(2) Uani 1 1 d .
H46 H 0.1594 0.3671 0.5785 0.070 Uiso 1 1 calc R
C47 C 0.2032(3) 0.4239(5) 0.5281(2) 0.0439(15) Uani 1 1 d .
C48 C 0.1729(4) 0.3472(5) 0.4881(2) 0.0581(18) Uani 1 1 d .
H48A H 0.1423 0.3803 0.4587 0.087 Uiso 1 1 calc R
H48B H 0.1452 0.2985 0.4998 0.087 Uiso 1 1 calc R
H48C H 0.2115 0.3135 0.4801 0.087 Uiso 1 1 calc R
C49 C 0.3226(4) 0.6544(6) 0.5506(2) 0.0608(18) Uani 1 1 d .
H49A H 0.3696 0.6270 0.5545 0.091 Uiso 1 1 calc R
H49B H 0.3262 0.7066 0.5751 0.091 Uiso 1 1 calc R
H49C H 0.3030 0.6823 0.5175 0.091 Uiso 1 1 calc R
C50 C 0.3667(3) 0.4050(5) 0.50851(19) 0.0446(15) Uani 1 1 d .
H50A H 0.3433 0.3864 0.5328 0.067 Uiso 1 1 calc R
H50B H 0.4096 0.4429 0.5247 0.067 Uiso 1 1 calc R
H50C H 0.3792 0.3449 0.4938 0.067 Uiso 1 1 calc R
C51 C 0.4543(3) 0.4040(5) 0.4311(2) 0.0549(18) Uani 1 1 d .
H51A H 0.4888 0.4106 0.4132 0.082 Uiso 1 1 calc R
H51B H 0.4425 0.3338 0.4329 0.082 Uiso 1 1 calc R
H51C H 0.4743 0.4305 0.4644 0.082 Uiso 1 1 calc R
C52 C 0.4117(3) 0.5089(4) 0.32269(19) 0.0376(13) Uani 1 1 d .
N53 N 0.4692(3) 0.4591(5) 0.33422(19) 0.0672(18) Uani 1 1 d .
C54 C 0.5155(4) 0.4577(6) 0.3042(2) 0.064(2) Uani 1 1 d .
C55 C 0.5732(4) 0.5216(7) 0.3146(2) 0.066(2) Uani 1 1 d .
C56 C 0.6214(3) 0.5124(7) 0.2879(2) 0.070(2) Uani 1 1 d .
H56 H 0.6597 0.5576 0.2938 0.083 Uiso 1 1 calc R
C57 C 0.6137(4) 0.4386(7) 0.2534(3) 0.078(3) Uani 1 1 d .
H57 H 0.6479 0.4313 0.2368 0.094 Uiso 1 1 calc R
C58 C 0.5564(5) 0.3750(8) 0.2428(3) 0.088(3) Uani 1 1 d .
H58 H 0.5515 0.3251 0.2185 0.106 Uiso 1 1 calc R
C59 C 0.5052(4) 0.3830(7) 0.2674(3) 0.075(2) Uani 1 1 d .
C60 C 0.4412(5) 0.3149(8) 0.2545(3) 0.107(3) Uani 1 1 d .
H60A H 0.3989 0.3525 0.2366 0.160 Uiso 1 1 calc R
H60B H 0.4351 0.2879 0.2847 0.160 Uiso 1 1 calc R
H60C H 0.4482 0.2604 0.2338 0.160 Uiso 1 1 calc R
C61 C 0.5845(4) 0.6001(8) 0.3540(3) 0.088(3) Uani 1 1 d .
H61A H 0.5546 0.6576 0.3407 0.133 Uiso 1 1 calc R
H61B H 0.6342 0.6205 0.3647 0.133 Uiso 1 1 calc R
H61C H 0.5721 0.5732 0.3820 0.133 Uiso 1 1 calc R
C62 C 0.3872(3) 0.5715(5) 0.2771(2) 0.0546(18) Uani 1 1 d .
H62A H 0.4261 0.5801 0.2633 0.082 Uiso 1 1 calc R
H62B H 0.3721 0.6365 0.2855 0.082 Uiso 1 1 calc R
H62C H 0.3475 0.5387 0.2529 0.082 Uiso 1 1 calc R
C63 C 0.1251(3) 0.6298(4) 0.44695(18) 0.0356(12) Uani 1 1 d .
C64 C 0.1349(3) 0.7074(6) 0.4800(2) 0.0568(19) Uani 1 1 d .
H64 H 0.1766 0.7463 0.4868 0.068 Uiso 1 1 calc R
C65 C 0.0847(5) 0.7301(8) 0.5036(2) 0.096(4) Uani 1 1 d .
H65 H 0.0927 0.7838 0.5262 0.115 Uiso 1 1 calc R
C66 C 0.0241(6) 0.6748(11) 0.4942(4) 0.121(5) Uani 1 1 d .
H66 H -0.0097 0.6903 0.5104 0.145 Uiso 1 1 calc R
C67 C 0.0121(4) 0.5971(9) 0.4615(4) 0.104(4) Uani 1 1 d .
H67 H -0.0297 0.5586 0.4554 0.125 Uiso 1 1 calc R
C68 C 0.0616(3) 0.5745(5) 0.4371(3) 0.0618(19) Uani 1 1 d .
H68 H 0.0524 0.5219 0.4139 0.074 Uiso 1 1 calc R
C69 C 0.3249(2) 0.8314(4) 0.38525(17) 0.0305(11) Uani 1 1 d .
C70 C 0.3446(3) 0.8064(5) 0.43603(18) 0.0401(13) Uani 1 1 d .
H70 H 0.3160 0.8278 0.4553 0.048 Uiso 1 1 calc R
C71 C 0.4056(3) 0.7506(5) 0.4580(2) 0.0527(16) Uani 1 1 d .
H71 H 0.4166 0.7325 0.4916 0.063 Uiso 1 1 calc R
C72 C 0.4498(3) 0.7215(5) 0.4323(2) 0.0568(18) Uani 1 1 d .
H72 H 0.4915 0.6852 0.4480 0.068 Uiso 1 1 calc R
C73 C 0.4324(3) 0.7461(5) 0.3825(2) 0.0545(17) Uani 1 1 d .
H73 H 0.4630 0.7270 0.3644 0.065 Uiso 1 1 calc R
C74 C 0.3708(3) 0.7983(4) 0.3591(2) 0.0413(13) Uani 1 1 d .
H74 H 0.3593 0.8121 0.3249 0.050 Uiso 1 1 calc R
C75 C 0.2707(3) 1.0101(4) 0.41168(17) 0.0356(12) Uani 1 1 d .
C76 C 0.3264(4) 1.0783(5) 0.4242(2) 0.0594(19) Uani 1 1 d .
H76 H 0.3532 1.0883 0.4023 0.071 Uiso 1 1 calc R
C77 C 0.3436(5) 1.1323(6) 0.4681(3) 0.080(2) Uani 1 1 d .
H77 H 0.3822 1.1773 0.4756 0.096 Uiso 1 1 calc R
C78 C 0.3063(5) 1.1217(6) 0.5003(2) 0.072(2) Uani 1 1 d .
H78 H 0.3182 1.1594 0.5297 0.087 Uiso 1 1 calc R
C79 C 0.2505(4) 1.0552(7) 0.4896(2) 0.070(2) Uani 1 1 d .
H79 H 0.2236 1.0474 0.5116 0.084 Uiso 1 1 calc R
C80 C 0.2337(3) 0.9990(6) 0.4457(2) 0.0531(17) Uani 1 1 d .
H80 H 0.1961 0.9523 0.4392 0.064 Uiso 1 1 calc R
O81 O 0.0130(5) 0.5448(7) 0.0463(3) 0.129(3) Uani 1 1 d .
C82 C -0.0525(6) 0.5477(12) 0.0111(6) 0.161(6) Uani 1 1 d .
H82A H -0.0779 0.6079 0.0161 0.242 Uiso 1 1 calc R
H82B H -0.0803 0.4893 0.0153 0.242 Uiso 1 1 calc R
C83 C 0.0484(8) 0.4518(11) 0.0390(5) 0.150(5) Uani 1 1 d .
H83A H 0.0964 0.4480 0.0630 0.225 Uiso 1 1 calc R
H83B H 0.0209 0.3936 0.0440 0.225 Uiso 1 1 calc R
O84 O 0.4693(4) 0.4983(7) 0.1305(4) 0.145(3) Uani 1 1 d .
C85 C 0.4791(7) 0.4824(9) 0.0838(5) 0.133(4) Uani 1 1 d .
H85A H 0.4513 0.4241 0.0677 0.199 Uiso 1 1 calc R
H85B H 0.5296 0.4689 0.0882 0.199 Uiso 1 1 calc R
C86 C 0.4568(8) 0.5686(8) 0.0533(4) 0.124(4) Uani 1 1 d .
H86A H 0.4615 0.5559 0.0204 0.186 Uiso 1 1 calc R
H86B H 0.4063 0.5822 0.0492 0.186 Uiso 1 1 calc R
O87 O 0.4981(4) 0.6528(6) 0.0746(3) 0.128(3) Uani 1 1 d .
C88 C 0.4887(6) 0.6706(8) 0.1224(3) 0.115(4) Uani 1 1 d .
H88A H 0.4383 0.6834 0.1187 0.173 Uiso 1 1 calc R
H88B H 0.5167 0.7289 0.1384 0.173 Uiso 1 1 calc R
C89 C 0.5134(8) 0.5798(10) 0.1526(4) 0.160(7) Uani 1 1 d .
H89A H 0.5629 0.5652 0.1546 0.241 Uiso 1 1 calc R
H89B H 0.5114 0.5905 0.1864 0.241 Uiso 1 1 calc R
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C .0033 .0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H .0000 .0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu .3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N .0061 .0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O .0106 .0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
C75 Pt1 C69 87.63(19) . .
C75 Pt1 N10 172.25(18) . .
C69 Pt1 N10 100.06(18) . .
C75 Pt1 N13 95.99(19) . .
C69 Pt1 N13 169.75(18) . .
N10 Pt1 N13 76.59(17) . .
C75 Pt1 Cu1 105.41(16) . .
C69 Pt1 Cu1 52.95(14) . .
N10 Pt1 Cu1 78.86(12) . .
N13 Pt1 Cu1 134.26(12) . .
C63 Pt2 C1 86.73(19) . .
C63 Pt2 N41 94.55(17) . .
C1 Pt2 N41 176.0(2) . .
C63 Pt2 N7 172.05(17) . .
C1 Pt2 N7 101.22(17) . .
N41 Pt2 N7 77.52(15) . .
C63 Pt2 Cu1 107.91(16) . .
C1 Pt2 Cu1 53.93(15) . .
N41 Pt2 Cu1 128.88(12) . .
N7 Pt2 Cu1 77.32(12) . .
C69 Cu1 C1 173.09(19) . .
C69 Cu1 C2 147.9(2) . .
C1 Cu1 C2 34.6(2) . .
C69 Cu1 C70 33.82(17) . .
C1 Cu1 C70 151.37(18) . .
C2 Cu1 C70 144.02(19) . .
C69 Cu1 Pt1 50.58(13) . .
C1 Cu1 Pt1 129.01(14) . .
C2 Cu1 Pt1 98.45(14) . .
C70 Cu1 Pt1 74.88(13) . .
C69 Cu1 Pt2 132.72(13) . .
C1 Cu1 Pt2 49.96(13) . .
C2 Cu1 Pt2 74.77(13) . .
C70 Cu1 Pt2 102.59(13) . .
Pt1 Cu1 Pt2 165.08(3) . .
C69 Cu1 Cu2 90.46(14) . .
C1 Cu1 Cu2 82.82(13) . .
C2 Cu1 Cu2 105.09(14) . .
C70 Cu1 Cu2 110.88(13) . .
Pt1 Cu1 Cu2 100.09(3) . .
Pt2 Cu1 Cu2 94.55(3) . .
N8 Cu2 N9 161.55(17) . .
N8 Cu2 N26 123.25(17) . .
N9 Cu2 N26 74.94(16) . .
N8 Cu2 Cu1 83.35(13) . .
N9 Cu2 Cu1 81.05(11) . .
N26 Cu2 Cu1 146.51(11) . .
C39 N7 N8 108.4(4) . .
C39 N7 Pt2 113.5(3) . .
N8 N7 Pt2 138.0(3) . .
N7 N8 C37 107.6(4) . .
N7 N8 Cu2 120.5(3) . .
C37 N8 Cu2 131.2(3) . .
N10 N9 C24 107.8(4) . .
N10 N9 Cu2 130.1(3) . .
C24 N9 Cu2 120.3(4) . .
N9 N10 C11 108.7(4) . .
N9 N10 Pt1 135.5(3) . .
C11 N10 Pt1 115.3(3) . .
C12 N13 C14 120.4(4) . .
C12 N13 Pt1 117.5(4) . .
C14 N13 Pt1 121.9(3) . .
C25 N26 C27 121.0(4) . .
C25 N26 Cu2 106.8(3) . .
C27 N26 Cu2 132.1(3) . .
C40 N41 C42 119.8(4) . .
C40 N41 Pt2 116.3(3) . .
C42 N41 Pt2 123.9(3) . .
C6 C1 C2 116.7(5) . .
C6 C1 Pt2 118.0(4) . .
C2 C1 Pt2 125.1(4) . .
C6 C1 Cu1 115.7(3) . .
C2 C1 Cu1 85.7(3) . .
Pt2 C1 Cu1 76.10(16) . .
C3 C2 C1 121.1(6) . .
C3 C2 Cu1 125.3(4) . .
C1 C2 Cu1 59.7(3) . .
C4 C3 C2 120.3(6) . .
C3 C4 C5 119.7(6) . .
C6 C5 C4 120.2(6) . .
C5 C6 C1 122.0(6) . .
N10 C11 C23 109.8(5) . .
N10 C11 C12 115.2(4) . .
C23 C11 C12 135.0(5) . .
N13 C12 C11 115.2(5) . .
N13 C12 C22 123.6(5) . .
C11 C12 C22 121.2(5) . .
C19 C14 C15 121.9(6) . .
C19 C14 N13 118.8(5) . .
C15 C14 N13 119.1(5) . .
C16 C15 C14 117.8(6) . .
C16 C15 C21 121.1(6) . .
C14 C15 C21 121.2(6) . .
C17 C16 C15 120.7(7) . .
C16 C17 C18 121.1(7) . .
C17 C18 C19 120.2(6) . .
C18 C19 C14 118.3(6) . .
C18 C19 C20 121.5(6) . .
C14 C19 C20 120.2(5) . .
C24 C23 C11 103.6(4) . .
C24 C23 C36 128.7(5) . .
C11 C23 C36 127.5(5) . .
N9 C24 C23 110.2(5) . .
N9 C24 C25 116.7(5) . .
C23 C24 C25 133.1(4) . .
N26 C25 C24 118.9(4) . .
N26 C25 C35 123.6(5) . .
C24 C25 C35 117.5(5) . .
C28 C27 C32 120.7(5) . .
C28 C27 N26 120.8(5) . .
C32 C27 N26 118.5(5) . .
C27 C28 C29 118.4(6) . .
C27 C28 C34 120.4(6) . .
C29 C28 C34 121.3(6) . .
C30 C29 C28 120.8(7) . .
C31 C30 C29 120.6(7) . .
C30 C31 C32 121.8(7) . .
C31 C32 C27 117.7(7) . .
C31 C32 C33 119.9(6) . .
C27 C32 C33 122.4(6) . .
N8 C37 C38 110.4(4) . .
N8 C37 C52 122.7(4) . .
C38 C37 C52 126.9(4) . .
C39 C38 C37 103.0(4) . .
C39 C38 C51 127.6(5) . .
C37 C38 C51 129.4(4) . .
N7 C39 C38 110.7(4) . .
N7 C39 C40 116.4(4) . .
C38 C39 C40 132.7(5) . .
N41 C40 C39 116.3(4) . .
N41 C40 C50 122.5(4) . .
C39 C40 C50 121.3(4) . .
C47 C42 C43 122.7(5) . .
C47 C42 N41 119.3(5) . .
C43 C42 N41 118.0(5) . .
C42 C43 C44 116.9(6) . .
C42 C43 C49 121.7(5) . .
C44 C43 C49 121.4(6) . .
C45 C44 C43 122.0(7) . .
C44 C45 C46 119.3(6) . .
C45 C46 C47 121.5(7) . .
C42 C47 C46 117.6(6) . .
C42 C47 C48 121.8(5) . .
C46 C47 C48 120.7(6) . .
N53 C52 C37 117.5(5) . .
N53 C52 C62 122.9(5) . .
C37 C52 C62 119.5(5) . .
C52 N53 C54 122.6(5) . .
C55 C54 C59 121.1(6) . .
C55 C54 N53 120.0(7) . .
C59 C54 N53 118.5(8) . .
C54 C55 C56 119.1(7) . .
C54 C55 C61 121.1(6) . .
C56 C55 C61 119.8(8) . .
C57 C56 C55 120.6(8) . .
C56 C57 C58 120.6(7) . .
C57 C58 C59 121.0(8) . .
C58 C59 C54 117.5(8) . .
C58 C59 C60 120.8(8) . .
C54 C59 C60 121.6(6) . .
C64 C63 C68 117.5(5) . .
C64 C63 Pt2 122.9(5) . .
C68 C63 Pt2 119.6(5) . .
C63 C64 C65 121.6(8) . .
C66 C65 C64 120.1(9) . .
C65 C66 C67 120.3(8) . .
C66 C67 C68 120.2(9) . .
C67 C68 C63 120.3(8) . .
C74 C69 C70 116.4(5) . .
C74 C69 Pt1 115.6(4) . .
C70 C69 Pt1 127.0(4) . .
C74 C69 Cu1 116.0(4) . .
C70 C69 Cu1 89.7(3) . .
Pt1 C69 Cu1 76.47(16) . .
C71 C70 C69 120.7(5) . .
C71 C70 Cu1 128.2(4) . .
C69 C70 Cu1 56.5(3) . .
C72 C71 C70 121.7(5) . .
C71 C72 C73 118.9(6) . .
C74 C73 C72 120.9(5) . .
C73 C74 C69 121.3(5) . .
C76 C75 C80 116.0(5) . .
C76 C75 Pt1 121.2(4) . .
C80 C75 Pt1 122.8(5) . .
C75 C76 C77 121.8(7) . .
C78 C77 C76 121.3(8) . .
C77 C78 C79 119.2(6) . .
C78 C79 C80 119.7(6) . .
C75 C80 C79 121.9(7) . .
C82 O81 C83 107.7(9) . .
O81 C82 C83 112.8(11) . 3_565
C82 C83 O81 107.8(11) 3_565 .
C89 O84 C85 106.6(9) . .
O84 C85 C86 109.9(10) . .
O87 C86 C85 110.8(10) . .
C86 O87 C88 108.0(8) . .
O87 C88 C89 107.0(10) . .
O84 C89 C88 109.2(9) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pt1 C75 2.012(5) .
Pt1 C69 2.042(5) .
Pt1 N10 2.095(4) .
Pt1 N13 2.106(4) .
Pt1 Cu1 2.5707(7) .
Pt2 C63 2.004(5) .
Pt2 C1 2.031(5) .
Pt2 N41 2.093(4) .
Pt2 N7 2.121(4) .
Pt2 Cu1 2.5744(7) .
Cu1 C69 2.110(5) .
Cu1 C1 2.144(5) .
Cu1 C2 2.476(5) .
Cu1 C70 2.530(5) .
Cu1 Cu2 2.7607(9) .
Cu2 N8 1.937(4) .
Cu2 N9 1.943(4) .
Cu2 N26 2.444(4) .
N7 C39 1.349(6) .
N7 N8 1.355(5) .
N8 C37 1.365(6) .
N9 N10 1.338(6) .
N9 C24 1.368(6) .
N10 C11 1.360(6) .
N13 C12 1.297(6) .
N13 C14 1.432(7) .
N26 C25 1.268(7) .
N26 C27 1.432(7) .
N41 C40 1.303(6) .
N41 C42 1.451(6) .
C1 C6 1.407(7) .
C1 C2 1.411(8) .
C2 C3 1.395(7) .
C3 C4 1.381(9) .
C4 C5 1.384(10) .
C5 C6 1.380(8) .
C11 C23 1.400(7) .
C11 C12 1.470(7) .
C12 C22 1.501(7) .
C14 C19 1.393(7) .
C14 C15 1.395(8) .
C15 C16 1.388(10) .
C15 C21 1.490(9) .
C16 C17 1.365(10) .
C17 C18 1.379(10) .
C18 C19 1.382(9) .
C19 C20 1.515(9) .
C23 C24 1.390(7) .
C23 C36 1.521(7) .
C24 C25 1.468(7) .
C25 C35 1.524(7) .
C27 C28 1.387(8) .
C27 C32 1.401(8) .
C28 C29 1.402(9) .
C28 C34 1.512(9) .
C29 C30 1.355(10) .
C30 C31 1.342(10) .
C31 C32 1.396(9) .
C32 C33 1.503(10) .
C37 C38 1.402(7) .
C37 C52 1.482(7) .
C38 C39 1.401(7) .
C38 C51 1.492(8) .
C39 C40 1.462(6) .
C40 C50 1.481(7) .
C42 C47 1.386(8) .
C42 C43 1.387(8) .
C43 C44 1.402(8) .
C43 C49 1.496(9) .
C44 C45 1.370(11) .
C45 C46 1.371(10) .
C46 C47 1.398(8) .
C47 C48 1.504(9) .
C52 N53 1.266(7) .
C52 C62 1.486(7) .
N53 C54 1.427(7) .
C54 C55 1.379(11) .
C54 C59 1.409(11) .
C55 C56 1.390(8) .
C55 C61 1.495(11) .
C56 C57 1.362(11) .
C57 C58 1.369(12) .
C58 C59 1.397(9) .
C59 C60 1.506(12) .
C63 C64 1.368(8) .
C63 C68 1.405(8) .
C64 C65 1.389(9) .
C65 C66 1.358(15) .
C66 C67 1.362(16) .
C67 C68 1.392(10) .
C69 C74 1.407(7) .
C69 C70 1.408(7) .
C70 C71 1.388(8) .
C71 C72 1.352(9) .
C72 C73 1.382(8) .
C73 C74 1.379(8) .
C75 C76 1.384(8) .
C75 C80 1.386(8) .
C76 C77 1.386(9) .
C77 C78 1.343(10) .
C78 C79 1.372(11) .
C79 C80 1.399(9) .
O81 C82 1.365(13) .
O81 C83 1.469(14) .
C82 C83 1.447(16) 3_565
C83 C82 1.447(16) 3_565
O84 C89 1.411(13) .
O84 C85 1.411(13) .
C85 C86 1.424(13) .
C86 O87 1.409(12) .
O87 C88 1.441(10) .
C88 C89 1.477(14) .
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_site_symmetry_4
C75 Pt1 Cu1 C69 -74.8(2) .
N10 Pt1 Cu1 C69 111.8(2) .
N13 Pt1 Cu1 C69 170.4(2) .
C75 Pt1 Cu1 C1 114.1(2) .
C69 Pt1 Cu1 C1 -171.1(2) .
N10 Pt1 Cu1 C1 -59.3(2) .
N13 Pt1 Cu1 C1 -0.7(2) .
C75 Pt1 Cu1 C2 95.9(2) .
C69 Pt1 Cu1 C2 170.7(2) .
N10 Pt1 Cu1 C2 -77.46(17) .
N13 Pt1 Cu1 C2 -18.9(2) .
C75 Pt1 Cu1 C70 -47.9(2) .
C69 Pt1 Cu1 C70 26.9(2) .
N10 Pt1 Cu1 C70 138.71(17) .
N13 Pt1 Cu1 C70 -162.7(2) .
C75 Pt1 Cu1 Pt2 34.18(19) .
C69 Pt1 Cu1 Pt2 109.0(2) .
N10 Pt1 Cu1 Pt2 -139.18(15) .
N13 Pt1 Cu1 Pt2 -80.63(19) .
C75 Pt1 Cu1 Cu2 -157.03(15) .
C69 Pt1 Cu1 Cu2 -82.20(17) .
N10 Pt1 Cu1 Cu2 29.62(11) .
N13 Pt1 Cu1 Cu2 88.17(16) .
C63 Pt2 Cu1 C69 116.5(2) .
C1 Pt2 Cu1 C69 -171.5(3) .
N41 Pt2 Cu1 C69 5.0(2) .
N7 Pt2 Cu1 C69 -57.3(2) .
C63 Pt2 Cu1 C1 -72.0(2) .
N41 Pt2 Cu1 C1 176.5(2) .
N7 Pt2 Cu1 C1 114.2(2) .
C63 Pt2 Cu1 C2 -44.2(2) .
C1 Pt2 Cu1 C2 27.8(2) .
N41 Pt2 Cu1 C2 -155.8(2) .
N7 Pt2 Cu1 C2 142.00(18) .
C63 Pt2 Cu1 C70 98.8(2) .
C1 Pt2 Cu1 C70 170.7(2) .
N41 Pt2 Cu1 C70 -12.79(19) .
N7 Pt2 Cu1 C70 -75.01(17) .
C63 Pt2 Cu1 Pt1 20.3(2) .
C1 Pt2 Cu1 Pt1 92.3(2) .
N41 Pt2 Cu1 Pt1 -91.26(17) .
N7 Pt2 Cu1 Pt1 -153.48(16) .
C63 Pt2 Cu1 Cu2 -148.63(16) .
C1 Pt2 Cu1 Cu2 -76.66(18) .
N41 Pt2 Cu1 Cu2 99.80(14) .
N7 Pt2 Cu1 Cu2 37.58(11) .
C69 Cu1 Cu2 N8 89.71(19) .
C1 Cu1 Cu2 N8 -91.89(19) .
C2 Cu1 Cu2 N8 -118.66(19) .
C70 Cu1 Cu2 N8 62.10(19) .
Pt1 Cu1 Cu2 N8 139.65(13) .
Pt2 Cu1 Cu2 N8 -43.23(13) .
C69 Cu1 Cu2 N9 -80.41(18) .
C1 Cu1 Cu2 N9 97.98(18) .
C2 Cu1 Cu2 N9 71.22(18) .
C70 Cu1 Cu2 N9 -108.02(19) .
Pt1 Cu1 Cu2 N9 -30.47(12) .
Pt2 Cu1 Cu2 N9 146.65(12) .
C69 Cu1 Cu2 N26 -124.8(2) .
C1 Cu1 Cu2 N26 53.6(2) .
C2 Cu1 Cu2 N26 26.8(2) .
C70 Cu1 Cu2 N26 -152.4(2) .
Pt1 Cu1 Cu2 N26 -74.8(2) .
Pt2 Cu1 Cu2 N26 102.3(2) .
C63 Pt2 N7 C39 4.0(17) .
C1 Pt2 N7 C39 -175.4(4) .
N41 Pt2 N7 C39 0.7(4) .
Cu1 Pt2 N7 C39 135.9(4) .
C63 Pt2 N7 N8 -170.5(14) .
C1 Pt2 N7 N8 10.1(5) .
N41 Pt2 N7 N8 -173.7(5) .
Cu1 Pt2 N7 N8 -38.6(5) .
C39 N7 N8 C37 -0.5(6) .
Pt2 N7 N8 C37 174.1(4) .
C39 N7 N8 Cu2 -171.6(3) .
Pt2 N7 N8 Cu2 3.1(7) .
N9 Cu2 N8 N7 63.8(7) .
N26 Cu2 N8 N7 -126.6(3) .
Cu1 Cu2 N8 N7 31.5(4) .
N9 Cu2 N8 C37 -104.9(6) .
N26 Cu2 N8 C37 64.7(5) .
Cu1 Cu2 N8 C37 -137.2(5) .
N8 Cu2 N9 N10 -11.7(8) .
N26 Cu2 N9 N10 177.3(4) .
Cu1 Cu2 N9 N10 20.9(4) .
N8 Cu2 N9 C24 -174.5(5) .
N26 Cu2 N9 C24 14.5(3) .
Cu1 Cu2 N9 C24 -142.0(4) .
C24 N9 N10 C11 1.1(5) .
Cu2 N9 N10 C11 -163.4(3) .
C24 N9 N10 Pt1 171.9(3) .
Cu2 N9 N10 Pt1 7.4(7) .
C75 Pt1 N10 N9 -155.8(13) .
C69 Pt1 N10 N9 17.1(5) .
N13 Pt1 N10 N9 -172.8(5) .
Cu1 Pt1 N10 N9 -31.7(4) .
C75 Pt1 N10 C11 14.5(16) .
C69 Pt1 N10 C11 -172.6(3) .
N13 Pt1 N10 C11 -2.5(3) .
Cu1 Pt1 N10 C11 138.6(3) .
C75 Pt1 N13 C12 -178.2(4) .
C69 Pt1 N13 C12 71.5(12) .
N10 Pt1 N13 C12 -0.5(4) .
Cu1 Pt1 N13 C12 -59.9(4) .
C75 Pt1 N13 C14 7.0(4) .
C69 Pt1 N13 C14 -103.3(10) .
N10 Pt1 N13 C14 -175.3(4) .
Cu1 Pt1 N13 C14 125.4(4) .
N8 Cu2 N26 C25 172.6(3) .
N9 Cu2 N26 C25 -10.8(4) .
Cu1 Cu2 N26 C25 34.9(5) .
N8 Cu2 N26 C27 -11.8(5) .
N9 Cu2 N26 C27 164.8(5) .
Cu1 Cu2 N26 C27 -149.5(4) .
C63 Pt2 N41 C40 178.3(4) .
C1 Pt2 N41 C40 70(2) .
N7 Pt2 N41 C40 -2.2(4) .
Cu1 Pt2 N41 C40 -64.3(4) .
C63 Pt2 N41 C42 -2.1(4) .
C1 Pt2 N41 C42 -111(2) .
N7 Pt2 N41 C42 177.5(4) .
Cu1 Pt2 N41 C42 115.3(4) .
C63 Pt2 C1 C6 -133.0(4) .
N41 Pt2 C1 C6 -24(3) .
N7 Pt2 C1 C6 46.9(4) .
Cu1 Pt2 C1 C6 112.0(4) .
C63 Pt2 C1 C2 40.6(5) .
N41 Pt2 C1 C2 149(2) .
N7 Pt2 C1 C2 -139.5(4) .
Cu1 Pt2 C1 C2 -74.4(4) .
C63 Pt2 C1 Cu1 115.0(2) .
N41 Pt2 C1 Cu1 -136(2) .
N7 Pt2 C1 Cu1 -65.08(18) .
C69 Cu1 C1 C6 1.0(19) .
C2 Cu1 C1 C6 117.6(5) .
C70 Cu1 C1 C6 -133.8(4) .
Pt1 Cu1 C1 C6 84.7(4) .
Pt2 Cu1 C1 C6 -114.6(5) .
Cu2 Cu1 C1 C6 -12.5(4) .
C69 Cu1 C1 C2 -116.6(16) .
C70 Cu1 C1 C2 108.6(5) .
Pt1 Cu1 C1 C2 -32.9(3) .
Pt2 Cu1 C1 C2 127.8(3) .
Cu2 Cu1 C1 C2 -130.1(3) .
C69 Cu1 C1 Pt2 115.6(16) .
C2 Cu1 C1 Pt2 -127.8(3) .
C70 Cu1 C1 Pt2 -19.1(5) .
Pt1 Cu1 C1 Pt2 -160.67(5) .
Cu2 Cu1 C1 Pt2 102.14(12) .
C6 C1 C2 C3 -1.2(8) .
Pt2 C1 C2 C3 -174.9(4) .
Cu1 C1 C2 C3 115.4(5) .
C6 C1 C2 Cu1 -116.6(5) .
Pt2 C1 C2 Cu1 69.7(3) .
C69 Cu1 C2 C3 59.7(7) .
C1 Cu1 C2 C3 -108.6(7) .
C70 Cu1 C2 C3 122.0(6) .
Pt1 Cu1 C2 C3 46.2(6) .
Pt2 Cu1 C2 C3 -147.4(6) .
Cu2 Cu1 C2 C3 -56.8(6) .
C69 Cu1 C2 C1 168.3(3) .
C70 Cu1 C2 C1 -129.4(4) .
Pt1 Cu1 C2 C1 154.7(3) .
Pt2 Cu1 C2 C1 -38.8(3) .
Cu2 Cu1 C2 C1 51.8(3) .
C1 C2 C3 C4 2.0(8) .
Cu1 C2 C3 C4 74.9(7) .
C2 C3 C4 C5 -0.9(9) .
C3 C4 C5 C6 -1.0(9) .
C4 C5 C6 C1 1.9(9) .
C2 C1 C6 C5 -0.7(8) .
Pt2 C1 C6 C5 173.4(4) .
Cu1 C1 C6 C5 -99.2(6) .
N9 N10 C11 C23 -0.8(5) .
Pt1 N10 C11 C23 -173.7(3) .
N9 N10 C11 C12 177.7(4) .
Pt1 N10 C11 C12 4.8(5) .
C14 N13 C12 C11 178.0(4) .
Pt1 N13 C12 C11 3.1(6) .
C14 N13 C12 C22 -0.8(8) .
Pt1 N13 C12 C22 -175.6(4) .
N10 C11 C12 N13 -5.2(7) .
C23 C11 C12 N13 172.8(5) .
N10 C11 C12 C22 173.5(5) .
C23 C11 C12 C22 -8.5(9) .
C12 N13 C14 C19 98.2(6) .
Pt1 N13 C14 C19 -87.2(5) .
C12 N13 C14 C15 -86.8(6) .
Pt1 N13 C14 C15 87.8(5) .
C19 C14 C15 C16 -3.2(9) .
N13 C14 C15 C16 -178.0(5) .
C19 C14 C15 C21 177.2(6) .
N13 C14 C15 C21 2.4(8) .
C14 C15 C16 C17 1.6(10) .
C21 C15 C16 C17 -178.9(6) .
C15 C16 C17 C18 0.1(11) .
C16 C17 C18 C19 -0.2(10) .
C17 C18 C19 C14 -1.3(9) .
C17 C18 C19 C20 178.8(6) .
C15 C14 C19 C18 3.1(8) .
N13 C14 C19 C18 177.9(5) .
C15 C14 C19 C20 -177.0(5) .
N13 C14 C19 C20 -2.2(8) .
N10 C11 C23 C24 0.2(6) .
C12 C11 C23 C24 -177.8(6) .
N10 C11 C23 C36 175.1(5) .
C12 C11 C23 C36 -3.0(10) .
N10 N9 C24 C23 -1.0(5) .
Cu2 N9 C24 C23 165.3(3) .
N10 N9 C24 C25 176.8(4) .
Cu2 N9 C24 C25 -16.9(6) .
C11 C23 C24 N9 0.5(6) .
C36 C23 C24 N9 -174.3(5) .
C11 C23 C24 C25 -176.8(5) .
C36 C23 C24 C25 8.4(10) .
C27 N26 C25 C24 -170.4(5) .
Cu2 N26 C25 C24 5.8(6) .
C27 N26 C25 C35 9.8(9) .
Cu2 N26 C25 C35 -174.0(5) .
N9 C24 C25 N26 5.1(7) .
C23 C24 C25 N26 -177.8(5) .
N9 C24 C25 C35 -175.1(5) .
C23 C24 C25 C35 2.1(9) .
C25 N26 C27 C28 -109.2(6) .
Cu2 N26 C27 C28 75.7(7) .
C25 N26 C27 C32 73.5(7) .
Cu2 N26 C27 C32 -101.6(6) .
C32 C27 C28 C29 1.3(9) .
N26 C27 C28 C29 -175.9(6) .
C32 C27 C28 C34 -178.0(6) .
N26 C27 C28 C34 4.8(9) .
C27 C28 C29 C30 -0.3(11) .
C34 C28 C29 C30 179.0(7) .
C28 C29 C30 C31 0.3(12) .
C29 C30 C31 C32 -1.4(13) .
C30 C31 C32 C27 2.3(12) .
C30 C31 C32 C33 -178.2(8) .
C28 C27 C32 C31 -2.3(10) .
N26 C27 C32 C31 175.0(6) .
C28 C27 C32 C33 178.2(7) .
N26 C27 C32 C33 -4.5(10) .
N7 N8 C37 C38 0.2(6) .
Cu2 N8 C37 C38 170.0(4) .
N7 N8 C37 C52 -177.3(5) .
Cu2 N8 C37 C52 -7.5(8) .
N8 C37 C38 C39 0.1(6) .
C52 C37 C38 C39 177.5(5) .
N8 C37 C38 C51 -177.3(6) .
C52 C37 C38 C51 0.1(10) .
N8 N7 C39 C38 0.6(6) .
Pt2 N7 C39 C38 -175.5(3) .
N8 N7 C39 C40 176.7(4) .
Pt2 N7 C39 C40 0.7(6) .
C37 C38 C39 N7 -0.5(6) .
C51 C38 C39 N7 177.0(6) .
C37 C38 C39 C40 -175.7(6) .
C51 C38 C39 C40 1.8(10) .
C42 N41 C40 C39 -176.5(5) .
Pt2 N41 C40 C39 3.2(6) .
C42 N41 C40 C50 2.0(8) .
Pt2 N41 C40 C50 -178.3(4) .
N7 C39 C40 N41 -2.6(7) .
C38 C39 C40 N41 172.5(6) .
N7 C39 C40 C50 178.9(5) .
C38 C39 C40 C50 -6.0(9) .
C40 N41 C42 C47 -91.7(6) .
Pt2 N41 C42 C47 88.7(5) .
C40 N41 C42 C43 90.4(6) .
Pt2 N41 C42 C43 -89.2(5) .
C47 C42 C43 C44 -0.1(8) .
N41 C42 C43 C44 177.7(5) .
C47 C42 C43 C49 178.5(6) .
N41 C42 C43 C49 -3.7(8) .
C42 C43 C44 C45 1.6(9) .
C49 C43 C44 C45 -177.0(6) .
C43 C44 C45 C46 -2.3(10) .
C44 C45 C46 C47 1.4(10) .
C43 C42 C47 C46 -0.7(8) .
N41 C42 C47 C46 -178.5(5) .
C43 C42 C47 C48 179.5(5) .
N41 C42 C47 C48 1.7(8) .
C45 C46 C47 C42 0.1(9) .
C45 C46 C47 C48 179.9(6) .
N8 C37 C52 N53 -177.8(6) .
C38 C37 C52 N53 5.2(9) .
N8 C37 C52 C62 4.4(8) .
C38 C37 C52 C62 -172.6(6) .
C37 C52 N53 C54 -178.3(7) .
C62 C52 N53 C54 -0.6(11) .
C52 N53 C54 C55 95.8(9) .
C52 N53 C54 C59 -90.9(9) .
C59 C54 C55 C56 0.7(10) .
N53 C54 C55 C56 173.9(6) .
C59 C54 C55 C61 -179.4(7) .
N53 C54 C55 C61 -6.2(10) .
C54 C55 C56 C57 -2.9(11) .
C61 C55 C56 C57 177.2(7) .
C55 C56 C57 C58 3.0(12) .
C56 C57 C58 C59 -0.9(14) .
C57 C58 C59 C54 -1.2(13) .
C57 C58 C59 C60 178.1(9) .
C55 C54 C59 C58 1.3(11) .
N53 C54 C59 C58 -172.0(7) .
C55 C54 C59 C60 -178.0(8) .
N53 C54 C59 C60 8.7(11) .
C1 Pt2 C63 C64 -103.2(5) .
N41 Pt2 C63 C64 80.6(5) .
N7 Pt2 C63 C64 77.4(17) .
Cu1 Pt2 C63 C64 -52.8(5) .
C1 Pt2 C63 C68 78.1(5) .
N41 Pt2 C63 C68 -98.1(5) .
N7 Pt2 C63 C68 -101.3(15) .
Cu1 Pt2 C63 C68 128.4(4) .
C68 C63 C64 C65 1.0(9) .
Pt2 C63 C64 C65 -177.7(5) .
C63 C64 C65 C66 -0.1(11) .
C64 C65 C66 C67 -0.1(14) .
C65 C66 C67 C68 -0.7(15) .
C66 C67 C68 C63 1.7(13) .
C64 C63 C68 C67 -1.8(9) .
Pt2 C63 C68 C67 176.9(6) .
C75 Pt1 C69 C74 -136.1(4) .
N10 Pt1 C69 C74 44.9(4) .
N13 Pt1 C69 C74 -25.1(13) .
Cu1 Pt1 C69 C74 112.6(4) .
C75 Pt1 C69 C70 32.3(5) .
N10 Pt1 C69 C70 -146.8(5) .
N13 Pt1 C69 C70 143.2(9) .
Cu1 Pt1 C69 C70 -79.1(5) .
C75 Pt1 C69 Cu1 111.37(19) .
N10 Pt1 C69 Cu1 -67.68(16) .
N13 Pt1 C69 Cu1 -137.7(10) .
C1 Cu1 C69 C74 -22.8(18) .
C2 Cu1 C69 C74 -129.7(4) .
C70 Cu1 C69 C74 119.5(6) .
Pt1 Cu1 C69 C74 -112.2(4) .
Pt2 Cu1 C69 C74 87.2(4) .
Cu2 Cu1 C69 C74 -9.5(4) .
C1 Cu1 C69 C70 -142.3(15) .
C2 Cu1 C69 C70 110.9(4) .
Pt1 Cu1 C69 C70 128.3(4) .
Pt2 Cu1 C69 C70 -32.3(4) .
Cu2 Cu1 C69 C70 -128.9(3) .
C1 Cu1 C69 Pt1 89.4(16) .
C2 Cu1 C69 Pt1 -17.5(4) .
C70 Cu1 C69 Pt1 -128.3(4) .
Pt2 Cu1 C69 Pt1 -160.65(6) .
Cu2 Cu1 C69 Pt1 102.72(11) .
C74 C69 C70 C71 -1.0(8) .
Pt1 C69 C70 C71 -169.3(5) .
Cu1 C69 C70 C71 118.0(6) .
C74 C69 C70 Cu1 -119.1(5) .
Pt1 C69 C70 Cu1 72.7(4) .
C69 Cu1 C70 C71 -105.0(6) .
C1 Cu1 C70 C71 66.2(7) .
C2 Cu1 C70 C71 132.6(5) .
Pt1 Cu1 C70 C71 -143.9(5) .
Pt2 Cu1 C70 C71 51.3(5) .
Cu2 Cu1 C70 C71 -48.6(5) .
C1 Cu1 C70 C69 171.2(4) .
C2 Cu1 C70 C69 -122.4(4) .
Pt1 Cu1 C70 C69 -38.9(3) .
Pt2 Cu1 C70 C69 156.3(3) .
Cu2 Cu1 C70 C69 56.4(3) .
C69 C70 C71 C72 2.6(10) .
Cu1 C70 C71 C72 72.1(8) .
C70 C71 C72 C73 -1.6(11) .
C71 C72 C73 C74 -0.8(11) .
C72 C73 C74 C69 2.3(10) .
C70 C69 C74 C73 -1.3(8) .
Pt1 C69 C74 C73 168.3(5) .
Cu1 C69 C74 C73 -104.9(6) .
C69 Pt1 C75 C76 84.0(5) .
N10 Pt1 C75 C76 -102.9(15) .
N13 Pt1 C75 C76 -86.4(5) .
Cu1 Pt1 C75 C76 134.5(5) .
C69 Pt1 C75 C80 -94.6(5) .
N10 Pt1 C75 C80 78.5(16) .
N13 Pt1 C75 C80 95.1(5) .
Cu1 Pt1 C75 C80 -44.1(5) .
C80 C75 C76 C77 -0.2(10) .
Pt1 C75 C76 C77 -178.9(6) .
C75 C76 C77 C78 -0.9(13) .
C76 C77 C78 C79 0.7(13) .
C77 C78 C79 C80 0.5(12) .
C76 C75 C80 C79 1.5(9) .
Pt1 C75 C80 C79 -179.9(5) .
C78 C79 C80 C75 -1.7(11) .
C83 O81 C82 C83 -61.1(17) 3_565
C82 O81 C83 C82 58.0(15) 3_565
C89 O84 C85 C86 -62.3(14) .
O84 C85 C86 O87 61.9(15) .
C85 C86 O87 C88 -60.3(14) .
C86 O87 C88 C89 60.0(11) .
C85 O84 C89 C88 64.0(14) .
O87 C88 C89 O84 -63.8(14) .
