#------------------------------------------------------------------------------
#$Date: 2016-03-23 21:29:25 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179450 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/47/4334777.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_4334777
loop_
_publ_author_name
'Kazuhiro Uemura'
'Masahiro Ebihara'
_publ_section_title
;
 Paramagnetic One-Dimensional Chains Comprised of Trinuclear Pt-Cu-Pt and
 Paddlewheel Dirhodium Complexes with Metal-Metal Bonds
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5535
_journal_page_last               5550
_journal_paper_doi               10.1021/ic400470g
_journal_volume                  52
_journal_year                    2013
_chemical_formula_sum            'C52 H116 Cl2 Cu2 F6 N16 O30 Pt4 Rh2'
_chemical_formula_weight         2743.77
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 105.7449(13)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   22.916(3)
_cell_length_b                   12.9623(14)
_cell_length_c                   33.225(4)
_cell_measurement_reflns_used    13154
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      31.0047
_cell_measurement_theta_min      1.8223
_cell_volume                     9499(2)
_computing_cell_refinement       CRYSTALCLEAR
_computing_data_collection       CRYSTALCLEAR
_computing_data_reduction        CRYSTALCLEAR
_computing_molecular_graphics
'Yadokari-XG 2009 (Wakita, Nemoto et al., 2009)'
_computing_publication_material
'Yadokari-XG 2009 (Wakita, Nemoto et al., 2009)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      123(2)
_diffrn_detector_area_resol_mean 14.6199
_diffrn_measured_fraction_theta_full 0.972
_diffrn_measured_fraction_theta_max 0.972
_diffrn_measurement_device_type  'Rigaku/MSC Mercury CCD'
_diffrn_measurement_method       dtprofit.ref
_diffrn_radiation_monochromator  'Graphite Monochromator'
_diffrn_radiation_source         'Rotating Anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0309
_diffrn_reflns_av_sigmaI/netI    0.0383
_diffrn_reflns_limit_h_max       29
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       43
_diffrn_reflns_limit_l_min       -40
_diffrn_reflns_number            34100
_diffrn_reflns_theta_full        27.49
_diffrn_reflns_theta_max         27.49
_diffrn_reflns_theta_min         3.10
_exptl_absorpt_coefficient_mu    6.787
_exptl_absorpt_correction_T_max  0.3439
_exptl_absorpt_correction_T_min  0.1721
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.919
_exptl_crystal_description       blcok
_exptl_crystal_F_000             5312
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.20
_refine_diff_density_max         2.136
_refine_diff_density_min         -1.728
_refine_diff_density_rms         0.165
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.089
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     532
_refine_ls_number_reflns         10602
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.089
_refine_ls_R_factor_all          0.0432
_refine_ls_R_factor_gt           0.0391
_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)+(0.0398P)²+81.1622P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0913
_refine_ls_wR_factor_ref         0.0947
_reflns_number_gt                9751
_reflns_number_total             10602
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic400470g_si_002_6.cif
_cod_data_source_block           7
_cod_original_cell_volume        9498.8(19)
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4334777
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Pt1 Pt 0.426636(9) 0.204961(15) 0.410385(7) 0.02145(6) Uani 1 1 d .
Pt2 Pt 0.299201(9) 0.501986(15) 0.312593(7) 0.02312(6) Uani 1 1 d .
Rh1 Rh 0.477169(18) 0.06357(3) 0.474732(14) 0.02215(10) Uani 1 1 d .
Cu1 Cu 0.36521(3) 0.35908(5) 0.36185(2) 0.02058(14) Uani 1 1 d .
O1 O 0.3575(2) 0.4218(3) 0.41376(13) 0.0327(9) Uani 1 1 d .
O8 O 0.41168(18) -0.0407(3) 0.44870(14) 0.0324(10) Uani 1 1 d .
O3 O 0.37693(19) 0.2950(3) 0.31164(13) 0.0301(9) Uani 1 1 d .
O2 O 0.29502(17) 0.2710(3) 0.35902(15) 0.0310(10) Uani 1 1 d .
O4 O 0.43557(17) 0.4461(3) 0.36529(14) 0.0320(10) Uani 1 1 d .
O6 O 0.54409(18) 0.1625(3) 0.50447(14) 0.0325(10) Uani 1 1 d .
N8 N 0.3814(2) 0.5645(3) 0.32034(15) 0.0220(9) Uani 1 1 d .
H46 H 0.3831 0.6234 0.3075 0.026 Uiso 1 1 calc R
O5 O 0.52933(19) 0.0104(3) 0.43877(14) 0.0324(9) Uani 1 1 d .
N4 N 0.34576(19) 0.1345(3) 0.39426(15) 0.0236(10) Uani 1 1 d .
H20 H 0.3439 0.0696 0.4016 0.028 Uiso 1 1 calc R
O7 O 0.42765(19) 0.1103(3) 0.51402(14) 0.0317(9) Uani 1 1 d .
N1 N 0.4512(2) 0.1245(4) 0.36434(17) 0.0327(11) Uani 1 1 d .
H21 H 0.4358 0.0594 0.3628 0.049 Uiso 1 1 calc R
H22 H 0.4923 0.1213 0.3705 0.049 Uiso 1 1 calc R
H23 H 0.4363 0.1570 0.3394 0.049 Uiso 1 1 calc R
N3 N 0.4002(2) 0.2858(3) 0.45379(15) 0.0255(10) Uani 1 1 d .
H10 H 0.4091 0.2594 0.4791 0.031 Uiso 1 1 calc R
N5 N 0.2876(2) 0.5951(4) 0.35970(17) 0.0336(12) Uani 1 1 d .
H47 H 0.3080 0.5681 0.3849 0.050 Uiso 1 1 calc R
H48 H 0.2475 0.5994 0.3582 0.050 Uiso 1 1 calc R
H49 H 0.3022 0.6593 0.3569 0.050 Uiso 1 1 calc R
N2 N 0.5077(2) 0.2835(4) 0.42552(19) 0.0396(14) Uani 1 1 d .
H24 H 0.5009 0.3510 0.4183 0.059 Uiso 1 1 calc R
H25 H 0.5329 0.2555 0.4115 0.059 Uiso 1 1 calc R
H26 H 0.5252 0.2787 0.4535 0.059 Uiso 1 1 calc R
C6 C 0.2960(2) 0.1794(4) 0.37354(18) 0.0229(11) Uani 1 1 d .
C11 C 0.3497(3) 0.3270(4) 0.27471(18) 0.0265(12) Uani 1 1 d .
C16 C 0.4327(2) 0.5262(4) 0.34267(19) 0.0245(11) Uani 1 1 d .
N7 N 0.3145(3) 0.4076(4) 0.26870(17) 0.0366(13) Uani 1 1 d .
H36 H 0.2953 0.4223 0.2426 0.044 Uiso 1 1 calc R
C1 C 0.3710(3) 0.3736(4) 0.44832(18) 0.0274(12) Uani 1 1 d .
C17 C 0.4930(3) 0.5786(5) 0.3440(2) 0.0353(14) Uani 1 1 d .
C7 C 0.2348(2) 0.1260(4) 0.3646(2) 0.0295(13) Uani 1 1 d .
C12 C 0.3614(3) 0.2674(5) 0.2382(2) 0.0329(13) Uani 1 1 d .
C21 C 0.5655(3) -0.0640(5) 0.4515(2) 0.0341(14) Uani 1 1 d .
C9 C 0.1944(3) 0.1965(6) 0.3834(3) 0.0471(18) Uani 1 1 d .
H14 H 0.2127 0.2041 0.4135 0.071 Uiso 1 1 calc R
H15 H 0.1540 0.1657 0.3785 0.071 Uiso 1 1 calc R
H16 H 0.1909 0.2645 0.3700 0.071 Uiso 1 1 calc R
C10 C 0.2391(3) 0.0185(5) 0.3846(3) 0.0457(18) Uani 1 1 d .
H17 H 0.2635 -0.0267 0.3719 0.069 Uiso 1 1 calc R
H18 H 0.1983 -0.0105 0.3799 0.069 Uiso 1 1 calc R
H19 H 0.2582 0.0240 0.4147 0.069 Uiso 1 1 calc R
C23 C 0.4149(3) -0.1303(5) 0.4642(2) 0.0357(15) Uani 1 1 d .
C8 C 0.2081(3) 0.1172(5) 0.3171(2) 0.0428(17) Uani 1 1 d .
H11 H 0.2049 0.1861 0.3045 0.064 Uiso 1 1 calc R
H12 H 0.1678 0.0858 0.3110 0.064 Uiso 1 1 calc R
H13 H 0.2346 0.0742 0.3054 0.064 Uiso 1 1 calc R
C24 C 0.3661(4) -0.2056(6) 0.4439(3) 0.060(3) Uani 1 1 d .
H56 H 0.3728 -0.2708 0.4595 0.090 Uiso 1 1 calc R
H57 H 0.3671 -0.2180 0.4150 0.090 Uiso 1 1 calc R
H58 H 0.3265 -0.1773 0.4440 0.090 Uiso 1 1 calc R
C2 C 0.3539(4) 0.4260(5) 0.4845(2) 0.051(2) Uani 1 1 d .
N6 N 0.2172(2) 0.4300(5) 0.3050(2) 0.058(2) Uani 1 1 d .
H50 H 0.2226 0.3713 0.3206 0.087 Uiso 1 1 calc R
H51 H 0.2013 0.4137 0.2775 0.087 Uiso 1 1 calc R
H52 H 0.1914 0.4729 0.3134 0.087 Uiso 1 1 calc R
C22 C 0.6032(4) -0.0983(6) 0.4236(3) 0.0500(19) Uani 1 1 d .
H53 H 0.6419 -0.0613 0.4310 0.075 Uiso 1 1 calc R
H54 H 0.5817 -0.0837 0.3944 0.075 Uiso 1 1 calc R
H55 H 0.6108 -0.1727 0.4271 0.075 Uiso 1 1 calc R
C5 C 0.3610(6) 0.3605(8) 0.5221(3) 0.086(4) Uani 1 1 d .
H7 H 0.3523 0.4014 0.5446 0.129 Uiso 1 1 calc R
H8 H 0.4026 0.3344 0.5312 0.129 Uiso 1 1 calc R
H9 H 0.3327 0.3023 0.5153 0.129 Uiso 1 1 calc R
C18 C 0.5047(5) 0.6572(10) 0.3782(4) 0.108(5) Uani 1 1 d .
H37 H 0.5157 0.6222 0.4054 0.162 Uiso 1 1 calc R
H38 H 0.4681 0.6985 0.3757 0.162 Uiso 1 1 calc R
H39 H 0.5380 0.7023 0.3761 0.162 Uiso 1 1 calc R
C15 C 0.3335(8) 0.1640(8) 0.2369(5) 0.132(6) Uani 1 1 d .
H33 H 0.3486 0.1190 0.2183 0.198 Uiso 1 1 calc R
H34 H 0.2893 0.1701 0.2264 0.198 Uiso 1 1 calc R
H35 H 0.3440 0.1345 0.2651 0.198 Uiso 1 1 calc R
C13 C 0.4288(5) 0.2582(14) 0.2447(4) 0.129(6) Uani 1 1 d .
H27 H 0.4449 0.2046 0.2656 0.193 Uiso 1 1 calc R
H28 H 0.4481 0.3243 0.2546 0.193 Uiso 1 1 calc R
H29 H 0.4371 0.2398 0.2182 0.193 Uiso 1 1 calc R
C4 C 0.3979(8) 0.5174(8) 0.4987(4) 0.133(7) Uani 1 1 d .
H4 H 0.3935 0.5660 0.4754 0.200 Uiso 1 1 calc R
H5 H 0.4397 0.4917 0.5073 0.200 Uiso 1 1 calc R
H6 H 0.3886 0.5526 0.5223 0.200 Uiso 1 1 calc R
C14 C 0.3350(9) 0.3216(10) 0.1966(4) 0.148(8) Uani 1 1 d .
H30 H 0.3417 0.2791 0.1739 0.223 Uiso 1 1 calc R
H31 H 0.3548 0.3886 0.1968 0.223 Uiso 1 1 calc R
H32 H 0.2913 0.3319 0.1923 0.223 Uiso 1 1 calc R
O9 O 0.3340(2) 0.0964(5) 0.1269(2) 0.0704(19) Uani 1 1 d .
O10 O 0.4191(2) 0.1770(6) 0.1208(2) 0.076(2) Uani 1 1 d .
C25 C 0.3638(3) 0.1574(7) 0.1113(3) 0.062(3) Uani 1 1 d .
F1 F 0.2723(3) 0.2327(9) 0.0740(4) 0.174(5) Uani 1 1 d .
C26 C 0.3281(4) 0.2182(9) 0.0747(4) 0.073(3) Uani 1 1 d .
C20 C 0.5418(4) 0.5002(7) 0.3523(6) 0.139(8) Uani 1 1 d .
H43 H 0.5438 0.4652 0.3788 0.209 Uiso 1 1 calc R
H44 H 0.5807 0.5339 0.3541 0.209 Uiso 1 1 calc R
H45 H 0.5332 0.4495 0.3296 0.209 Uiso 1 1 calc R
F3 F 0.3503(4) 0.3097(8) 0.0701(4) 0.183(5) Uani 1 1 d .
C19 C 0.4901(5) 0.6371(13) 0.3049(4) 0.145(8) Uani 1 1 d .
H40 H 0.5239 0.6860 0.3100 0.218 Uiso 1 1 calc R
H41 H 0.4516 0.6749 0.2963 0.218 Uiso 1 1 calc R
H42 H 0.4928 0.5889 0.2828 0.218 Uiso 1 1 calc R
F2 F 0.3251(6) 0.1732(10) 0.0391(3) 0.188(5) Uani 1 1 d .
C3 C 0.2913(6) 0.4687(15) 0.4695(4) 0.153(8) Uani 1 1 d .
H1 H 0.2878 0.5094 0.4441 0.230 Uiso 1 1 calc R
H2 H 0.2829 0.5128 0.4913 0.230 Uiso 1 1 calc R
H3 H 0.2620 0.4118 0.4634 0.230 Uiso 1 1 calc R
O15 O 0.4187(18) -0.0386(11) 0.1877(9) 0.52(3) Uani 1 1 d .
Cl1 Cl 0.14500(9) 0.36533(12) 0.18585(7) 0.0533(5) Uani 1 1 d .
O12 O 0.1831(3) 0.4495(4) 0.2027(2) 0.0666(18) Uani 1 1 d .
O13 O 0.1425(4) 0.2939(5) 0.2172(2) 0.091(2) Uani 1 1 d .
O14 O 0.0875(3) 0.4012(6) 0.1626(3) 0.096(3) Uani 1 1 d .
O11 O 0.1733(5) 0.3106(5) 0.1579(3) 0.117(3) Uani 1 1 d .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu 0.3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh -1.1178 0.9187 '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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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
N4 Pt1 N3 89.56(19) . .
N4 Pt1 N1 89.4(2) . .
N3 Pt1 N1 177.95(19) . .
N4 Pt1 N2 177.29(19) . .
N3 Pt1 N2 89.7(2) . .
N1 Pt1 N2 91.2(2) . .
N4 Pt1 Cu1 83.32(13) . .
N3 Pt1 Cu1 80.39(13) . .
N1 Pt1 Cu1 97.73(14) . .
N2 Pt1 Cu1 93.99(14) . .
N4 Pt1 Rh1 93.80(13) . .
N3 Pt1 Rh1 86.35(13) . .
N1 Pt1 Rh1 95.49(14) . .
N2 Pt1 Rh1 88.76(15) . .
Cu1 Pt1 Rh1 166.434(19) . .
N8 Pt2 N7 89.8(2) . .
N8 Pt2 N5 88.6(2) . .
N7 Pt2 N5 176.9(2) . .
N8 Pt2 N6 176.8(2) . .
N7 Pt2 N6 88.1(3) . .
N5 Pt2 N6 93.3(3) . .
N8 Pt2 Cu1 81.06(12) . .
N7 Pt2 Cu1 80.80(14) . .
N5 Pt2 Cu1 96.34(14) . .
N6 Pt2 Cu1 96.20(16) . .
O5 Rh1 O8 90.49(19) . .
O5 Rh1 O6 90.76(19) . .
O8 Rh1 O6 176.15(17) . .
O5 Rh1 O7 176.10(16) . .
O8 Rh1 O7 89.71(18) . .
O6 Rh1 O7 88.80(18) . .
O5 Rh1 Rh1 87.91(11) . 5_656
O8 Rh1 Rh1 88.42(11) . 5_656
O6 Rh1 Rh1 87.98(11) . 5_656
O7 Rh1 Rh1 88.20(11) . 5_656
O5 Rh1 Pt1 87.75(11) . .
O8 Rh1 Pt1 90.32(11) . .
O6 Rh1 Pt1 93.37(11) . .
O7 Rh1 Pt1 96.15(11) . .
Rh1 Rh1 Pt1 175.47(3) 5_656 .
O4 Cu1 O3 89.57(19) . .
O4 Cu1 O2 179.35(18) . .
O3 Cu1 O2 90.73(19) . .
O4 Cu1 O1 88.8(2) . .
O3 Cu1 O1 177.19(17) . .
O2 Cu1 O1 90.9(2) . .
O4 Cu1 Pt2 87.49(12) . .
O3 Cu1 Pt2 87.56(12) . .
O2 Cu1 Pt2 93.10(11) . .
O1 Cu1 Pt2 94.64(11) . .
O4 Cu1 Pt1 95.97(12) . .
O3 Cu1 Pt1 91.45(12) . .
O2 Cu1 Pt1 83.45(11) . .
O1 Cu1 Pt1 86.47(11) . .
Pt2 Cu1 Pt1 176.39(3) . .
C1 O1 Cu1 122.3(4) . .
C23 O8 Rh1 118.9(4) . .
C11 O3 Cu1 122.4(4) . .
C6 O2 Cu1 126.5(3) . .
C16 O4 Cu1 121.9(3) . .
C23 O6 Rh1 118.9(4) 5_656 .
C16 N8 Pt2 126.1(4) . .
C16 N8 H46 116.9 . .
Pt2 N8 H46 116.9 . .
C21 O5 Rh1 120.0(4) . .
C6 N4 Pt1 123.5(4) . .
C6 N4 H20 118.2 . .
Pt1 N4 H20 118.2 . .
C21 O7 Rh1 119.0(4) 5_656 .
Pt1 N1 H21 109.5 . .
Pt1 N1 H22 109.5 . .
H21 N1 H22 109.5 . .
Pt1 N1 H23 109.5 . .
H21 N1 H23 109.5 . .
H22 N1 H23 109.5 . .
C1 N3 Pt1 126.7(4) . .
C1 N3 H10 116.6 . .
Pt1 N3 H10 116.6 . .
Pt2 N5 H47 109.5 . .
Pt2 N5 H48 109.5 . .
H47 N5 H48 109.5 . .
Pt2 N5 H49 109.5 . .
H47 N5 H49 109.5 . .
H48 N5 H49 109.5 . .
Pt1 N2 H24 109.5 . .
Pt1 N2 H25 109.5 . .
H24 N2 H25 109.5 . .
Pt1 N2 H26 109.5 . .
H24 N2 H26 109.5 . .
H25 N2 H26 109.5 . .
O2 C6 N4 122.6(5) . .
O2 C6 C7 115.4(5) . .
N4 C6 C7 122.0(5) . .
O3 C11 N7 121.7(5) . .
O3 C11 C12 116.9(5) . .
N7 C11 C12 121.4(5) . .
O4 C16 N8 122.7(5) . .
O4 C16 C17 116.3(5) . .
N8 C16 C17 121.0(5) . .
C11 N7 Pt2 126.9(4) . .
C11 N7 H36 116.5 . .
Pt2 N7 H36 116.5 . .
O1 C1 N3 123.0(6) . .
O1 C1 C2 116.3(5) . .
N3 C1 C2 120.6(5) . .
C20 C17 C19 111.4(10) . .
C20 C17 C18 110.8(10) . .
C19 C17 C18 105.8(10) . .
C20 C17 C16 109.4(5) . .
C19 C17 C16 112.0(6) . .
C18 C17 C16 107.4(6) . .
C6 C7 C10 112.5(5) . .
C6 C7 C8 108.8(5) . .
C10 C7 C8 109.8(5) . .
C6 C7 C9 105.9(5) . .
C10 C7 C9 109.7(6) . .
C8 C7 C9 110.1(6) . .
C15 C12 C13 110.5(10) . .
C15 C12 C14 109.2(10) . .
C13 C12 C14 107.9(10) . .
C15 C12 C11 108.4(7) . .
C13 C12 C11 108.7(6) . .
C14 C12 C11 112.1(6) . .
O5 C21 O7 124.9(6) . 5_656
O5 C21 C22 117.2(6) . .
O7 C21 C22 118.0(5) 5_656 .
C7 C9 H14 109.5 . .
C7 C9 H15 109.5 . .
H14 C9 H15 109.5 . .
C7 C9 H16 109.5 . .
H14 C9 H16 109.5 . .
H15 C9 H16 109.5 . .
C7 C10 H17 109.5 . .
C7 C10 H18 109.5 . .
H17 C10 H18 109.5 . .
C7 C10 H19 109.5 . .
H17 C10 H19 109.5 . .
H18 C10 H19 109.5 . .
O8 C23 O6 125.7(5) . 5_656
O8 C23 C24 117.5(6) . .
O6 C23 C24 116.8(5) 5_656 .
C7 C8 H11 109.5 . .
C7 C8 H12 109.5 . .
H11 C8 H12 109.5 . .
C7 C8 H13 109.5 . .
H11 C8 H13 109.5 . .
H12 C8 H13 109.5 . .
C23 C24 H56 109.5 . .
C23 C24 H57 109.5 . .
H56 C24 H57 109.5 . .
C23 C24 H58 109.5 . .
H56 C24 H58 109.5 . .
H57 C24 H58 109.5 . .
C5 C2 C3 111.7(9) . .
C5 C2 C1 114.7(6) . .
C3 C2 C1 109.4(7) . .
C5 C2 C4 105.7(9) . .
C3 C2 C4 107.9(11) . .
C1 C2 C4 107.2(8) . .
Pt2 N6 H50 109.5 . .
Pt2 N6 H51 109.5 . .
H50 N6 H51 109.5 . .
Pt2 N6 H52 109.5 . .
H50 N6 H52 109.5 . .
H51 N6 H52 109.5 . .
C21 C22 H53 109.5 . .
C21 C22 H54 109.5 . .
H53 C22 H54 109.5 . .
C21 C22 H55 109.5 . .
H53 C22 H55 109.5 . .
H54 C22 H55 109.5 . .
C2 C5 H7 109.5 . .
C2 C5 H8 109.5 . .
H7 C5 H8 109.5 . .
C2 C5 H9 109.5 . .
H7 C5 H9 109.5 . .
H8 C5 H9 109.5 . .
C17 C18 H37 109.5 . .
C17 C18 H38 109.5 . .
H37 C18 H38 109.5 . .
C17 C18 H39 109.5 . .
H37 C18 H39 109.5 . .
H38 C18 H39 109.5 . .
C12 C15 H33 109.5 . .
C12 C15 H34 109.5 . .
H33 C15 H34 109.5 . .
C12 C15 H35 109.5 . .
H33 C15 H35 109.5 . .
H34 C15 H35 109.5 . .
C12 C13 H27 109.5 . .
C12 C13 H28 109.5 . .
H27 C13 H28 109.5 . .
C12 C13 H29 109.5 . .
H27 C13 H29 109.5 . .
H28 C13 H29 109.5 . .
C2 C4 H4 109.5 . .
C2 C4 H5 109.5 . .
H4 C4 H5 109.5 . .
C2 C4 H6 109.5 . .
H4 C4 H6 109.5 . .
H5 C4 H6 109.5 . .
C12 C14 H30 109.5 . .
C12 C14 H31 109.5 . .
H30 C14 H31 109.5 . .
C12 C14 H32 109.5 . .
H30 C14 H32 109.5 . .
H31 C14 H32 109.5 . .
O9 C25 O10 131.1(11) . .
O9 C25 C26 115.7(7) . .
O10 C25 C26 113.2(9) . .
F1 C26 F2 104.0(11) . .
F1 C26 F3 106.2(10) . .
F2 C26 F3 103.0(12) . .
F1 C26 C25 114.5(10) . .
F2 C26 C25 112.7(10) . .
F3 C26 C25 115.2(9) . .
C17 C20 H43 109.5 . .
C17 C20 H44 109.5 . .
H43 C20 H44 109.5 . .
C17 C20 H45 109.5 . .
H43 C20 H45 109.5 . .
H44 C20 H45 109.5 . .
C17 C19 H40 109.5 . .
C17 C19 H41 109.5 . .
H40 C19 H41 109.5 . .
C17 C19 H42 109.5 . .
H40 C19 H42 109.5 . .
H41 C19 H42 109.5 . .
C2 C3 H1 109.5 . .
C2 C3 H2 109.5 . .
H1 C3 H2 109.5 . .
C2 C3 H3 109.5 . .
H1 C3 H3 109.5 . .
H2 C3 H3 109.5 . .
O13 Cl1 O14 113.8(5) . .
O13 Cl1 O12 111.1(4) . .
O14 Cl1 O12 110.2(4) . .
O13 Cl1 O11 105.4(5) . .
O14 Cl1 O11 108.8(6) . .
O12 Cl1 O11 107.2(5) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pt1 N4 2.004(4) .
Pt1 N3 2.005(5) .
Pt1 N1 2.053(5) .
Pt1 N2 2.057(5) .
Pt1 Cu1 2.7094(6) .
Pt1 Rh1 2.8155(5) .
Pt2 N8 2.001(4) .
Pt2 N7 2.006(5) .
Pt2 N5 2.050(5) .
Pt2 N6 2.051(5) .
Pt2 Cu1 2.6560(6) .
Rh1 O5 2.026(4) .
Rh1 O8 2.030(4) .
Rh1 O6 2.037(4) .
Rh1 O7 2.040(4) .
Rh1 Rh1 2.3826(8) 5_656
Cu1 O4 1.946(4) .
Cu1 O3 1.946(4) .
Cu1 O2 1.953(4) .
Cu1 O1 1.957(4) .
O1 C1 1.269(7) .
O8 C23 1.265(7) .
O3 C11 1.285(7) .
O2 C6 1.280(6) .
O4 C16 1.273(7) .
O6 C23 1.269(7) 5_656
N8 C16 1.306(7) .
N8 H46 0.8800 .
O5 C21 1.266(7) .
N4 C6 1.299(7) .
N4 H20 0.8800 .
O7 C21 1.266(7) 5_656
N1 H21 0.9100 .
N1 H22 0.9100 .
N1 H23 0.9100 .
N3 C1 1.308(7) .
N3 H10 0.8800 .
N5 H47 0.9100 .
N5 H48 0.9100 .
N5 H49 0.9100 .
N2 H24 0.9100 .
N2 H25 0.9100 .
N2 H26 0.9100 .
C6 C7 1.519(7) .
C11 N7 1.302(7) .
C11 C12 1.522(8) .
C16 C17 1.530(8) .
N7 H36 0.8800 .
C1 C2 1.523(9) .
C17 C20 1.481(11) .
C17 C19 1.490(12) .
C17 C18 1.496(12) .
C7 C10 1.535(8) .
C7 C8 1.536(9) .
C7 C9 1.547(9) .
C12 C15 1.480(11) .
C12 C13 1.505(12) .
C12 C14 1.521(13) .
C21 O7 1.266(7) 5_656
C21 C22 1.496(10) .
C9 H14 0.9800 .
C9 H15 0.9800 .
C9 H16 0.9800 .
C10 H17 0.9800 .
C10 H18 0.9800 .
C10 H19 0.9800 .
C23 O6 1.270(7) 5_656
C23 C24 1.499(9) .
C8 H11 0.9800 .
C8 H12 0.9800 .
C8 H13 0.9800 .
C24 H56 0.9800 .
C24 H57 0.9800 .
C24 H58 0.9800 .
C2 C5 1.482(11) .
C2 C3 1.492(13) .
C2 C4 1.544(14) .
N6 H50 0.9100 .
N6 H51 0.9100 .
N6 H52 0.9100 .
C22 H53 0.9800 .
C22 H54 0.9800 .
C22 H55 0.9800 .
C5 H7 0.9800 .
C5 H8 0.9800 .
C5 H9 0.9800 .
C18 H37 0.9800 .
C18 H38 0.9800 .
C18 H39 0.9800 .
C15 H33 0.9800 .
C15 H34 0.9800 .
C15 H35 0.9800 .
C13 H27 0.9800 .
C13 H28 0.9800 .
C13 H29 0.9800 .
C4 H4 0.9800 .
C4 H5 0.9800 .
C4 H6 0.9800 .
C14 H30 0.9800 .
C14 H31 0.9800 .
C14 H32 0.9800 .
O9 C25 1.246(11) .
O10 C25 1.247(8) .
C25 C26 1.494(15) .
F1 C26 1.286(10) .
C26 F2 1.304(14) .
C26 F3 1.316(13) .
C20 H43 0.9800 .
C20 H44 0.9800 .
C20 H45 0.9800 .
C19 H40 0.9800 .
C19 H41 0.9800 .
C19 H42 0.9800 .
C3 H1 0.9800 .
C3 H2 0.9800 .
C3 H3 0.9800 .
Cl1 O13 1.406(7) .
Cl1 O14 1.412(6) .
Cl1 O12 1.414(5) .
Cl1 O11 1.453(9) .
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_1
_geom_torsion_site_symmetry_4
N4 Pt1 Rh1 O5 109.96(19) . .
N3 Pt1 Rh1 O5 -160.72(18) . .
N1 Pt1 Rh1 O5 20.2(2) . .
N2 Pt1 Rh1 O5 -70.9(2) . .
Cu1 Pt1 Rh1 O5 -172.88(14) . .
N4 Pt1 Rh1 O8 19.49(19) . .
N3 Pt1 Rh1 O8 108.81(19) . .
N1 Pt1 Rh1 O8 -70.3(2) . .
N2 Pt1 Rh1 O8 -161.4(2) . .
Cu1 Pt1 Rh1 O8 96.65(15) . .
N4 Pt1 Rh1 O6 -159.41(19) . .
N3 Pt1 Rh1 O6 -70.09(19) . .
N1 Pt1 Rh1 O6 110.8(2) . .
N2 Pt1 Rh1 O6 19.7(2) . .
Cu1 Pt1 Rh1 O6 -82.25(15) . .
N4 Pt1 Rh1 O7 -70.25(18) . .
N3 Pt1 Rh1 O7 19.06(18) . .
N1 Pt1 Rh1 O7 -160.0(2) . .
N2 Pt1 Rh1 O7 108.8(2) . .
Cu1 Pt1 Rh1 O7 6.90(15) . .
N4 Pt1 Rh1 Rh1 93.3(4) . 5_656
N3 Pt1 Rh1 Rh1 -177(26) . 5_656
N1 Pt1 Rh1 Rh1 3.5(4) . 5_656
N2 Pt1 Rh1 Rh1 -87.6(4) . 5_656
Cu1 Pt1 Rh1 Rh1 170.4(3) . 5_656
N8 Pt2 Cu1 O4 3.60(19) . .
N7 Pt2 Cu1 O4 94.9(2) . .
N5 Pt2 Cu1 O4 -84.0(2) . .
N6 Pt2 Cu1 O4 -178.0(3) . .
N8 Pt2 Cu1 O3 -86.08(18) . .
N7 Pt2 Cu1 O3 5.2(2) . .
N5 Pt2 Cu1 O3 -173.6(2) . .
N6 Pt2 Cu1 O3 92.3(3) . .
N8 Pt2 Cu1 O2 -176.68(19) . .
N7 Pt2 Cu1 O2 -85.4(2) . .
N5 Pt2 Cu1 O2 95.8(2) . .
N6 Pt2 Cu1 O2 1.7(3) . .
N8 Pt2 Cu1 O1 92.16(19) . .
N7 Pt2 Cu1 O1 -176.6(2) . .
N5 Pt2 Cu1 O1 4.6(2) . .
N6 Pt2 Cu1 O1 -89.5(3) . .
N8 Pt2 Cu1 Pt1 -160.1(5) . .
N7 Pt2 Cu1 Pt1 -68.8(5) . .
N5 Pt2 Cu1 Pt1 112.4(5) . .
N6 Pt2 Cu1 Pt1 18.3(5) . .
N4 Pt1 Cu1 O4 -174.6(2) . .
N3 Pt1 Cu1 O4 94.7(2) . .
N1 Pt1 Cu1 O4 -86.1(2) . .
N2 Pt1 Cu1 O4 5.6(2) . .
Rh1 Pt1 Cu1 O4 106.98(16) . .
N4 Pt1 Cu1 O3 -84.92(19) . .
N3 Pt1 Cu1 O3 -175.61(18) . .
N1 Pt1 Cu1 O3 3.6(2) . .
N2 Pt1 Cu1 O3 95.4(2) . .
Rh1 Pt1 Cu1 O3 -163.30(14) . .
N4 Pt1 Cu1 O2 5.7(2) . .
N3 Pt1 Cu1 O2 -85.03(19) . .
N1 Pt1 Cu1 O2 94.1(2) . .
N2 Pt1 Cu1 O2 -174.1(2) . .
Rh1 Pt1 Cu1 O2 -72.72(16) . .
N4 Pt1 Cu1 O1 96.97(19) . .
N3 Pt1 Cu1 O1 6.28(19) . .
N1 Pt1 Cu1 O1 -174.5(2) . .
N2 Pt1 Cu1 O1 -82.7(2) . .
Rh1 Pt1 Cu1 O1 18.59(16) . .
N4 Pt1 Cu1 Pt2 -11.0(5) . .
N3 Pt1 Cu1 Pt2 -101.7(5) . .
N1 Pt1 Cu1 Pt2 77.4(5) . .
N2 Pt1 Cu1 Pt2 169.2(5) . .
Rh1 Pt1 Cu1 Pt2 -89.4(5) . .
O4 Cu1 O1 C1 -107.1(5) . .
O3 Cu1 O1 C1 -53(4) . .
O2 Cu1 O1 C1 72.3(5) . .
Pt2 Cu1 O1 C1 165.5(4) . .
Pt1 Cu1 O1 C1 -11.1(5) . .
O5 Rh1 O8 C23 86.4(5) . .
O6 Rh1 O8 C23 -22(3) . .
O7 Rh1 O8 C23 -89.7(5) . .
Rh1 Rh1 O8 C23 -1.5(5) 5_656 .
Pt1 Rh1 O8 C23 174.2(5) . .
O4 Cu1 O3 C11 -93.6(4) . .
O2 Cu1 O3 C11 86.9(4) . .
O1 Cu1 O3 C11 -147(3) . .
Pt2 Cu1 O3 C11 -6.1(4) . .
Pt1 Cu1 O3 C11 170.4(4) . .
O4 Cu1 O2 C6 -33(20) . .
O3 Cu1 O2 C6 84.8(5) . .
O1 Cu1 O2 C6 -92.9(5) . .
Pt2 Cu1 O2 C6 172.4(5) . .
Pt1 Cu1 O2 C6 -6.6(5) . .
O3 Cu1 O4 C16 79.4(5) . .
O2 Cu1 O4 C16 -163(33) . .
O1 Cu1 O4 C16 -102.9(5) . .
Pt2 Cu1 O4 C16 -8.2(5) . .
Pt1 Cu1 O4 C16 170.8(5) . .
O5 Rh1 O6 C23 -86.1(5) . 5_656
O8 Rh1 O6 C23 23(3) . 5_656
O7 Rh1 O6 C23 90.0(5) . 5_656
Rh1 Rh1 O6 C23 1.8(5) 5_656 5_656
Pt1 Rh1 O6 C23 -173.9(5) . 5_656
N7 Pt2 N8 C16 -81.1(5) . .
N5 Pt2 N8 C16 96.2(5) . .
N6 Pt2 N8 C16 -31(5) . .
Cu1 Pt2 N8 C16 -0.4(5) . .
O8 Rh1 O5 C21 -88.2(5) . .
O6 Rh1 O5 C21 88.2(5) . .
O7 Rh1 O5 C21 5(3) . .
Rh1 Rh1 O5 C21 0.2(5) 5_656 .
Pt1 Rh1 O5 C21 -178.5(5) . .
N3 Pt1 N4 C6 73.1(5) . .
N1 Pt1 N4 C6 -105.1(5) . .
N2 Pt1 N4 C6 -1(5) . .
Cu1 Pt1 N4 C6 -7.3(5) . .
Rh1 Pt1 N4 C6 159.4(5) . .
O5 Rh1 O7 C21 -5(3) . 5_656
O8 Rh1 O7 C21 87.9(5) . 5_656
O6 Rh1 O7 C21 -88.5(5) . 5_656
Rh1 Rh1 O7 C21 -0.5(5) 5_656 5_656
Pt1 Rh1 O7 C21 178.2(4) . 5_656
N4 Pt1 N3 C1 -87.4(5) . .
N1 Pt1 N3 C1 -28(6) . .
N2 Pt1 N3 C1 90.0(5) . .
Cu1 Pt1 N3 C1 -4.1(5) . .
Rh1 Pt1 N3 C1 178.7(5) . .
Cu1 O2 C6 N4 3.2(9) . .
Cu1 O2 C6 C7 -176.4(4) . .
Pt1 N4 C6 O2 5.0(8) . .
Pt1 N4 C6 C7 -175.4(4) . .
Cu1 O3 C11 N7 3.2(8) . .
Cu1 O3 C11 C12 -177.9(4) . .
Cu1 O4 C16 N8 10.4(8) . .
Cu1 O4 C16 C17 -171.6(4) . .
Pt2 N8 C16 O4 -5.7(8) . .
Pt2 N8 C16 C17 176.4(4) . .
O3 C11 N7 Pt2 4.2(9) . .
C12 C11 N7 Pt2 -174.6(4) . .
N8 Pt2 N7 C11 74.4(6) . .
N5 Pt2 N7 C11 15(5) . .
N6 Pt2 N7 C11 -103.1(6) . .
Cu1 Pt2 N7 C11 -6.6(5) . .
Cu1 O1 C1 N3 11.6(8) . .
Cu1 O1 C1 C2 -171.1(5) . .
Pt1 N3 C1 O1 -2.8(8) . .
Pt1 N3 C1 C2 180.0(5) . .
O4 C16 C17 C20 30.0(11) . .
N8 C16 C17 C20 -152.0(10) . .
O4 C16 C17 C19 153.9(10) . .
N8 C16 C17 C19 -28.0(11) . .
O4 C16 C17 C18 -90.3(9) . .
N8 C16 C17 C18 87.7(9) . .
O2 C6 C7 C10 -177.5(6) . .
N4 C6 C7 C10 3.0(9) . .
O2 C6 C7 C8 60.7(7) . .
N4 C6 C7 C8 -118.9(6) . .
O2 C6 C7 C9 -57.6(7) . .
N4 C6 C7 C9 122.8(6) . .
O3 C11 C12 C15 68.4(10) . .
N7 C11 C12 C15 -112.8(10) . .
O3 C11 C12 C13 -51.8(10) . .
N7 C11 C12 C13 127.1(10) . .
O3 C11 C12 C14 -171.0(9) . .
N7 C11 C12 C14 7.8(11) . .
Rh1 O5 C21 O7 0.1(9) . 5_656
Rh1 O5 C21 C22 -179.2(5) . .
Rh1 O8 C23 O6 0.5(10) . 5_656
Rh1 O8 C23 C24 -179.4(6) . .
O1 C1 C2 C5 170.3(8) . .
N3 C1 C2 C5 -12.3(11) . .
O1 C1 C2 C3 44.0(12) . .
N3 C1 C2 C3 -138.6(10) . .
O1 C1 C2 C4 -72.7(9) . .
N3 C1 C2 C4 104.7(9) . .
O9 C25 C26 F1 26.7(13) . .
O10 C25 C26 F1 -153.5(10) . .
O9 C25 C26 F2 -91.9(11) . .
O10 C25 C26 F2 87.9(11) . .
O9 C25 C26 F3 150.3(10) . .
O10 C25 C26 F3 -29.9(13) . .
