#------------------------------------------------------------------------------
#$Date: 2016-03-25 16:05:40 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179951 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/46/7024620.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_7024620
loop_
_publ_author_name
'Shieh, Minghuey'
'Chu, Yen-Yi'
'Miu, Chia-Yeh'
'Wu, Pei-Fan'
'Zeng, Tsau-Ming'
_publ_section_title
;
 Bimetallic Ru-Cu tellurido complexes: controlled synthesis and
 electrochemical studies of copper halide-TeRu(5) and Te(2)Ru(4) clusters.
;
_journal_issue                   6
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1492
_journal_page_last               1503
_journal_paper_doi               10.1039/b919176c
_journal_volume                  39
_journal_year                    2010
_chemical_formula_moiety         'C76 H40 Br2 Cu4 O28 P2 Ru10 Te2'
_chemical_formula_sum            'C76 H40 Br2 Cu4 O28 P2 Ru10 Te2'
_chemical_formula_weight         3142.90
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                104.842(16)
_cell_angle_beta                 96.48(5)
_cell_angle_gamma                98.60(4)
_cell_formula_units_Z            1
_cell_length_a                   9.439(12)
_cell_length_b                   15.450(3)
_cell_length_c                   16.008(4)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      12.42
_cell_measurement_theta_min      8.63
_cell_volume                     2203(3)
_computing_cell_refinement       'CAD4 Express (Enraf Nonius, 1994)'
_computing_data_collection       'CAD4 Express (Enraf Nonius, 1994)'
_computing_data_reduction        'XCAD4 (Harms & Wocadlo, 1995)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1986)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Enraf Nonius TurboCAD4'
_diffrn_measurement_method       'non-profiled omega/2theta scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           Mok\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0471
_diffrn_reflns_av_sigmaI/netI    0.0750
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            8965
_diffrn_reflns_theta_full        25.92
_diffrn_reflns_theta_max         25.92
_diffrn_reflns_theta_min         1.63
_diffrn_standards_decay_%        2
_diffrn_standards_interval_time  120
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    4.270
_exptl_absorpt_correction_T_max  0.5952
_exptl_absorpt_correction_T_min  0.4456
_exptl_absorpt_correction_type   psi-scan
_exptl_absorpt_process_details
;
?
;
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    2.369
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1480
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.12
_refine_diff_density_max         1.398
_refine_diff_density_min         -1.110
_refine_diff_density_rms         0.188
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.990
_refine_ls_hydrogen_treatment    fixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     559
_refine_ls_number_reflns         8636
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.990
_refine_ls_R_factor_all          0.1085
_refine_ls_R_factor_gt           0.0453
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0709P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1107
_refine_ls_wR_factor_ref         0.1354
_reflns_number_gt                5063
_reflns_number_total             8636
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b919176c.txt
_cod_data_source_block           compound_3b
_cod_database_code               7024620
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
C1 C -0.0900(11) 0.8005(7) 0.0364(7) 0.046(2) Uani 1 1 d .
C2 C 0.1540(11) 0.7815(7) -0.0280(6) 0.043(2) Uani 1 1 d .
C3 C 0.0985(11) 0.7091(7) 0.1090(7) 0.047(2) Uani 1 1 d .
C4 C 0.1312(11) 1.1187(8) 0.1779(7) 0.051(3) Uani 1 1 d .
C5 C 0.3770(11) 1.0937(6) 0.1216(7) 0.043(2) Uani 1 1 d .
C6 C 0.3506(10) 1.1019(7) 0.2949(6) 0.041(2) Uani 1 1 d .
C7 C 0.3334(12) 1.0254(7) 0.4244(7) 0.049(3) Uani 1 1 d .
C8 C 0.5786(11) 0.9981(7) 0.3407(7) 0.049(3) Uani 1 1 d .
C9 C 0.3580(11) 0.8518(7) 0.3560(7) 0.048(2) Uani 1 1 d .
C10 C 0.1313(13) 0.7092(7) 0.2786(7) 0.057(3) Uani 1 1 d .
C11 C 0.3873(10) 0.7079(7) 0.2097(7) 0.043(2) Uani 1 1 d .
C12 C -0.1207(12) 0.8516(8) 0.2190(7) 0.056(3) Uani 1 1 d .
C13 C 0.0251(11) 1.0353(8) 0.3103(7) 0.046(2) Uani 1 1 d .
C14 C 0.0603(10) 0.8884(8) 0.3690(7) 0.048(3) Uani 1 1 d .
C15 C 0.6348(9) 0.3640(6) 0.3333(6) 0.035(2) Uani 1 1 d .
C16 C 0.6566(12) 0.3750(7) 0.4232(6) 0.050(3) Uani 1 1 d .
H16 H 0.6274 0.4234 0.4607 0.060 Uiso 1 1 calc R
C17 C 0.7216(12) 0.3143(8) 0.4566(7) 0.057(3) Uani 1 1 d .
H17 H 0.7378 0.3223 0.5168 0.069 Uiso 1 1 calc R
C18 C 0.7623(11) 0.2423(7) 0.4017(8) 0.052(3) Uani 1 1 d .
H18 H 0.8037 0.2005 0.4244 0.063 Uiso 1 1 calc R
C19 C 0.7430(11) 0.2313(7) 0.3145(8) 0.051(3) Uani 1 1 d .
H19 H 0.7739 0.1830 0.2779 0.061 Uiso 1 1 calc R
C20 C 0.6783(10) 0.2905(6) 0.2792(7) 0.044(2) Uani 1 1 d .
H20 H 0.6636 0.2814 0.2189 0.053 Uiso 1 1 calc R
C21 C 0.6390(11) 0.5559(6) 0.3654(6) 0.042(2) Uani 1 1 d .
C22 C 0.7871(12) 0.5757(8) 0.3938(7) 0.060(3) Uani 1 1 d .
H22 H 0.8429 0.5316 0.3762 0.072 Uiso 1 1 calc R
C23 C 0.8521(12) 0.6596(8) 0.4475(7) 0.061(3) Uani 1 1 d .
H23 H 0.9523 0.6736 0.4643 0.073 Uiso 1 1 calc R
C24 C 0.7689(15) 0.7221(8) 0.4760(7) 0.065(3) Uani 1 1 d .
H24 H 0.8127 0.7788 0.5135 0.079 Uiso 1 1 calc R
C25 C 0.6209(14) 0.7032(7) 0.4505(8) 0.064(3) Uani 1 1 d .
H25 H 0.5652 0.7464 0.4718 0.077 Uiso 1 1 calc R
C26 C 0.5563(13) 0.6212(7) 0.3941(7) 0.053(3) Uani 1 1 d .
H26 H 0.4568 0.6090 0.3748 0.063 Uiso 1 1 calc R
C27 C 0.3641(10) 0.4285(6) 0.2855(7) 0.042(2) Uani 1 1 d .
C28 C 0.2966(12) 0.3831(8) 0.3372(7) 0.055(3) Uani 1 1 d .
H28 H 0.3496 0.3602 0.3764 0.066 Uiso 1 1 calc R
C29 C 0.1463(13) 0.3721(9) 0.3295(9) 0.072(4) Uani 1 1 d .
H29 H 0.0986 0.3409 0.3639 0.086 Uiso 1 1 calc R
C30 C 0.0691(13) 0.4050(9) 0.2743(10) 0.079(4) Uani 1 1 d .
H30 H -0.0309 0.3981 0.2720 0.095 Uiso 1 1 calc R
C31 C 0.1376(14) 0.4503(9) 0.2193(9) 0.074(4) Uani 1 1 d .
H31 H 0.0843 0.4726 0.1797 0.088 Uiso 1 1 calc R
C32 C 0.2823(12) 0.4599(8) 0.2262(8) 0.061(3) Uani 1 1 d .
H32 H 0.3294 0.4887 0.1899 0.073 Uiso 1 1 calc R
C33 C 0.5981(10) 0.4408(7) 0.1836(6) 0.041(2) Uani 1 1 d .
C34 C 0.5221(12) 0.3717(7) 0.1135(7) 0.056(3) Uani 1 1 d .
H34 H 0.4498 0.3285 0.1223 0.067 Uiso 1 1 calc R
C35 C 0.5523(15) 0.3662(9) 0.0302(8) 0.072(4) Uani 1 1 d .
H35 H 0.5038 0.3181 -0.0170 0.087 Uiso 1 1 calc R
C36 C 0.6549(16) 0.4327(11) 0.0179(9) 0.083(4) Uani 1 1 d .
H36 H 0.6729 0.4304 -0.0385 0.100 Uiso 1 1 calc R
C37 C 0.7304(15) 0.5013(11) 0.0856(9) 0.086(4) Uani 1 1 d .
H37 H 0.8010 0.5449 0.0759 0.103 Uiso 1 1 calc R
C38 C 0.7026(12) 0.5066(8) 0.1690(7) 0.061(3) Uani 1 1 d .
H38 H 0.7537 0.5542 0.2158 0.073 Uiso 1 1 calc R
Br Br 0.25286(11) 0.98184(8) -0.11041(7) 0.0501(3) Uani 1 1 d .
Cu1 Cu 0.14672(14) 0.96306(9) 0.00943(8) 0.0491(3) Uani 1 1 d .
Cu2 Cu 0.03256(12) 1.03226(8) -0.12164(8) 0.0415(3) Uani 1 1 d .
O1 O -0.2059(9) 0.7699(6) 0.0011(6) 0.083(3) Uani 1 1 d .
O2 O 0.1787(9) 0.7446(6) -0.0949(5) 0.070(2) Uani 1 1 d .
O3 O 0.0478(10) 0.6323(5) 0.0786(6) 0.076(2) Uani 1 1 d .
O4 O 0.0807(9) 1.1821(5) 0.1832(6) 0.073(3) Uani 1 1 d .
O5 O 0.4548(8) 1.1370(5) 0.0930(5) 0.065(2) Uani 1 1 d .
O6 O 0.3870(8) 1.1750(5) 0.3402(5) 0.0572(19) Uani 1 1 d .
O7 O 0.3116(10) 1.0621(6) 0.4922(5) 0.072(2) Uani 1 1 d .
O8 O 0.6978(8) 1.0137(7) 0.3559(6) 0.082(3) Uani 1 1 d .
O9 O 0.3835(9) 0.8308(6) 0.4184(5) 0.070(2) Uani 1 1 d .
O10 O 0.0604(12) 0.6601(6) 0.3085(7) 0.101(4) Uani 1 1 d .
O11 O 0.4700(9) 0.6623(6) 0.2025(5) 0.070(2) Uani 1 1 d .
O12 O -0.2409(9) 0.8122(7) 0.2031(6) 0.090(3) Uani 1 1 d .
O13 O -0.0013(8) 1.1030(5) 0.3453(5) 0.065(2) Uani 1 1 d .
O14 O 0.0525(10) 0.8720(6) 0.4339(6) 0.079(3) Uani 1 1 d .
P P 0.5584(3) 0.44678(17) 0.29142(16) 0.0379(6) Uani 1 1 d .
Ru1 Ru 0.10776(8) 0.82974(5) 0.08429(5) 0.03414(18) Uani 1 1 d .
Ru2 Ru 0.24684(8) 1.02925(5) 0.17672(5) 0.03243(18) Uani 1 1 d .
Ru3 Ru 0.36860(8) 0.96754(5) 0.31375(5) 0.03614(19) Uani 1 1 d .
Ru4 Ru 0.24562(8) 0.78398(5) 0.22765(5) 0.03771(19) Uani 1 1 d .
Ru5 Ru 0.06778(8) 0.91678(5) 0.26173(5) 0.03412(18) Uani 1 1 d .
Te Te 0.39141(6) 0.89117(4) 0.14283(4) 0.03611(16) 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
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'
Br Br -0.2901 2.4595 '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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Te Te -0.5308 1.6751 '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
O1 C1 Ru1 169.4(10) . .
O1 C1 Cu2 118.5(8) . 2_575
Ru1 C1 Cu2 72.1(3) . 2_575
O2 C2 Ru1 173.7(9) . .
O3 C3 Ru1 141.4(9) . .
O3 C3 Ru4 133.6(9) . .
Ru1 C3 Ru4 85.0(4) . .
O4 C4 Ru2 169.5(10) . .
O4 C4 Cu2 117.8(8) . 2_575
Ru2 C4 Cu2 72.7(4) . 2_575
O5 C5 Ru2 175.6(9) . .
O6 C6 Ru2 143.5(8) . .
O6 C6 Ru3 132.6(8) . .
Ru2 C6 Ru3 83.9(4) . .
O7 C7 Ru3 179.1(10) . .
O8 C8 Ru3 178.7(10) . .
O9 C9 Ru3 140.0(9) . .
O9 C9 Ru4 134.9(9) . .
Ru3 C9 Ru4 84.6(4) . .
O10 C10 Ru4 177.9(10) . .
O11 C11 Ru4 177.0(9) . .
O12 C12 Ru5 171.5(10) . .
O13 C13 Ru5 174.1(9) . .
O14 C14 Ru5 178.3(9) . .
C20 C15 C16 118.5(9) . .
C20 C15 P 122.1(7) . .
C16 C15 P 119.4(7) . .
C17 C16 C15 120.0(10) . .
C17 C16 H16 120.0 . .
C15 C16 H16 120.0 . .
C18 C17 C16 120.1(10) . .
C18 C17 H17 120.0 . .
C16 C17 H17 120.0 . .
C19 C18 C17 120.4(10) . .
C19 C18 H18 119.8 . .
C17 C18 H18 119.8 . .
C18 C19 C20 120.8(10) . .
C18 C19 H19 119.6 . .
C20 C19 H19 119.6 . .
C19 C20 C15 120.1(10) . .
C19 C20 H20 119.9 . .
C15 C20 H20 119.9 . .
C22 C21 C26 119.3(10) . .
C22 C21 P 119.3(8) . .
C26 C21 P 121.4(8) . .
C23 C22 C21 120.6(11) . .
C23 C22 H22 119.7 . .
C21 C22 H22 119.7 . .
C24 C23 C22 119.2(11) . .
C24 C23 H23 120.4 . .
C22 C23 H23 120.4 . .
C23 C24 C25 121.3(11) . .
C23 C24 H24 119.4 . .
C25 C24 H24 119.4 . .
C26 C25 C24 119.7(11) . .
C26 C25 H25 120.2 . .
C24 C25 H25 120.2 . .
C25 C26 C21 119.9(11) . .
C25 C26 H26 120.0 . .
C21 C26 H26 120.0 . .
C28 C27 C32 119.7(10) . .
C28 C27 P 121.2(8) . .
C32 C27 P 119.0(8) . .
C27 C28 C29 118.1(11) . .
C27 C28 H28 121.0 . .
C29 C28 H28 121.0 . .
C30 C29 C28 121.7(12) . .
C30 C29 H29 119.1 . .
C28 C29 H29 119.1 . .
C29 C30 C31 120.6(11) . .
C29 C30 H30 119.7 . .
C31 C30 H30 119.7 . .
C32 C31 C30 117.5(12) . .
C32 C31 H31 121.3 . .
C30 C31 H31 121.3 . .
C31 C32 C27 122.3(12) . .
C31 C32 H32 118.8 . .
C27 C32 H32 118.8 . .
C34 C33 C38 119.1(10) . .
C34 C33 P 119.9(8) . .
C38 C33 P 121.0(8) . .
C33 C34 C35 120.3(11) . .
C33 C34 H34 119.8 . .
C35 C34 H34 119.8 . .
C36 C35 C34 119.1(12) . .
C36 C35 H35 120.5 . .
C34 C35 H35 120.5 . .
C37 C36 C35 121.5(12) . .
C37 C36 H36 119.2 . .
C35 C36 H36 119.2 . .
C36 C37 C38 119.8(13) . .
C36 C37 H37 120.1 . .
C38 C37 H37 120.1 . .
C37 C38 C33 120.1(11) . .
C37 C38 H38 120.0 . .
C33 C38 H38 120.0 . .
Cu1 Br Cu2 73.12(7) . .
Br Cu1 Cu2 161.47(7) . 2_575
Br Cu1 Ru2 129.68(8) . .
Cu2 Cu1 Ru2 60.65(7) 2_575 .
Br Cu1 Ru1 134.01(7) . .
Cu2 Cu1 Ru1 60.85(5) 2_575 .
Ru2 Cu1 Ru1 71.54(5) . .
Br Cu1 Cu2 53.56(7) . .
Cu2 Cu1 Cu2 107.95(8) 2_575 .
Ru2 Cu1 Cu2 135.38(6) . .
Ru1 Cu1 Cu2 144.74(7) . .
Br Cu2 C4 98.4(3) . 2_575
Br Cu2 C1 105.3(2) . 2_575
C4 Cu2 C1 152.7(4) 2_575 2_575
Br Cu2 Cu1 125.35(8) . 2_575
C4 Cu2 Cu1 76.7(3) 2_575 2_575
C1 Cu2 Cu1 78.6(2) 2_575 2_575
Br Cu2 Ru2 141.23(8) . 2_575
C4 Cu2 Ru2 43.1(3) 2_575 2_575
C1 Cu2 Ru2 113.1(2) 2_575 2_575
Cu1 Cu2 Ru2 60.02(7) 2_575 2_575
Br Cu2 Ru1 147.58(7) . 2_575
C4 Cu2 Ru1 113.4(3) 2_575 2_575
C1 Cu2 Ru1 42.4(2) 2_575 2_575
Cu1 Cu2 Ru1 60.29(6) 2_575 2_575
Ru2 Cu2 Ru1 71.06(7) 2_575 2_575
Br Cu2 Ru5 121.63(7) . 2_575
C4 Cu2 Ru5 91.3(2) 2_575 2_575
C1 Cu2 Ru5 87.9(2) 2_575 2_575
Cu1 Cu2 Ru5 112.94(8) 2_575 2_575
Ru2 Cu2 Ru5 66.88(6) 2_575 2_575
Ru1 Cu2 Ru5 66.08(4) 2_575 2_575
Br Cu2 Cu1 53.32(5) . .
C4 Cu2 Cu1 85.4(2) 2_575 .
C1 Cu2 Cu1 97.8(2) 2_575 .
Cu1 Cu2 Cu1 72.05(8) 2_575 .
Ru2 Cu2 Cu1 113.78(7) 2_575 .
Ru1 Cu2 Cu1 120.66(6) 2_575 .
Ru5 Cu2 Cu1 173.24(6) 2_575 .
C33 P C15 110.6(4) . .
C33 P C21 110.6(4) . .
C15 P C21 106.4(5) . .
C33 P C27 107.8(5) . .
C15 P C27 111.5(4) . .
C21 P C27 110.1(5) . .
C1 Ru1 C2 89.6(4) . .
C1 Ru1 C3 91.1(4) . .
C2 Ru1 C3 91.1(4) . .
C1 Ru1 Cu1 90.6(3) . .
C2 Ru1 Cu1 72.0(3) . .
C3 Ru1 Cu1 162.9(3) . .
C1 Ru1 Cu2 65.6(3) . 2_575
C2 Ru1 Cu2 123.1(3) . 2_575
C3 Ru1 Cu2 136.4(3) . 2_575
Cu1 Ru1 Cu2 58.87(5) . 2_575
C1 Ru1 Te 172.0(3) . .
C2 Ru1 Te 88.6(3) . .
C3 Ru1 Te 96.8(3) . .
Cu1 Ru1 Te 81.37(5) . .
Cu2 Ru1 Te 109.14(7) 2_575 .
C1 Ru1 Ru4 128.1(3) . .
C2 Ru1 Ru4 119.1(3) . .
C3 Ru1 Ru4 50.0(3) . .
Cu1 Ru1 Ru4 137.23(6) . .
Cu2 Ru1 Ru4 116.33(5) 2_575 .
Te Ru1 Ru4 59.27(5) . .
C1 Ru1 Ru5 96.0(3) . .
C2 Ru1 Ru5 173.7(3) . .
C3 Ru1 Ru5 91.7(3) . .
Cu1 Ru1 Ru5 105.01(4) . .
Cu2 Ru1 Ru5 57.48(4) 2_575 .
Te Ru1 Ru5 85.50(7) . .
Ru4 Ru1 Ru5 59.23(4) . .
C1 Ru1 Ru2 119.3(3) . .
C2 Ru1 Ru2 116.0(3) . .
C3 Ru1 Ru2 137.6(3) . .
Cu1 Ru1 Ru2 53.93(4) . .
Cu2 Ru1 Ru2 54.20(7) 2_575 .
Te Ru1 Ru2 54.95(5) . .
Ru4 Ru1 Ru2 87.59(5) . .
Ru5 Ru1 Ru2 58.60(4) . .
C4 Ru2 C5 88.0(4) . .
C4 Ru2 C6 89.2(4) . .
C5 Ru2 C6 91.4(4) . .
C4 Ru2 Cu1 87.4(3) . .
C5 Ru2 Cu1 75.5(3) . .
C6 Ru2 Cu1 166.6(3) . .
C4 Ru2 Cu2 64.3(3) . 2_575
C5 Ru2 Cu2 126.4(3) . 2_575
C6 Ru2 Cu2 129.9(3) . 2_575
Cu1 Ru2 Cu2 59.33(6) . 2_575
C4 Ru2 Te 169.2(3) . .
C5 Ru2 Te 89.0(3) . .
C6 Ru2 Te 101.3(3) . .
Cu1 Ru2 Te 81.78(6) . .
Cu2 Ru2 Te 109.76(7) 2_575 .
C4 Ru2 Ru3 130.5(3) . .
C5 Ru2 Ru3 117.2(3) . .
C6 Ru2 Ru3 51.2(3) . .
Cu1 Ru2 Ru3 137.84(5) . .
Cu2 Ru2 Ru3 115.55(6) 2_575 .
Te Ru2 Ru3 59.82(4) . .
C4 Ru2 Ru5 98.0(3) . .
C5 Ru2 Ru5 174.0(3) . .
C6 Ru2 Ru5 88.3(3) . .
Cu1 Ru2 Ru5 104.93(6) . .
Cu2 Ru2 Ru5 57.37(6) 2_575 .
Te Ru2 Ru5 85.12(6) . .
Ru3 Ru2 Ru5 58.39(7) . .
C4 Ru2 Ru1 118.2(3) . .
C5 Ru2 Ru1 119.4(3) . .
C6 Ru2 Ru1 137.5(3) . .
Cu1 Ru2 Ru1 54.53(4) . .
Cu2 Ru2 Ru1 54.75(5) 2_575 .
Te Ru2 Ru1 55.02(6) . .
Ru3 Ru2 Ru1 87.24(5) . .
Ru5 Ru2 Ru1 57.93(4) . .
C7 Ru3 C8 96.5(5) . .
C7 Ru3 C9 86.1(4) . .
C8 Ru3 C9 93.5(4) . .
C7 Ru3 C6 80.8(4) . .
C8 Ru3 C6 92.8(4) . .
C9 Ru3 C6 166.1(4) . .
C7 Ru3 Te 172.7(3) . .
C8 Ru3 Te 89.1(3) . .
C9 Ru3 Te 98.3(3) . .
C6 Ru3 Te 94.2(3) . .
C7 Ru3 Ru5 87.9(3) . .
C8 Ru3 Ru5 175.6(3) . .
C9 Ru3 Ru5 86.9(3) . .
C6 Ru3 Ru5 87.8(3) . .
Te Ru3 Ru5 86.57(7) . .
C7 Ru3 Ru2 115.3(3) . .
C8 Ru3 Ru2 114.7(3) . .
C9 Ru3 Ru2 140.7(3) . .
C6 Ru3 Ru2 44.9(3) . .
Te Ru3 Ru2 57.71(4) . .
Ru5 Ru3 Ru2 63.01(5) . .
C7 Ru3 Ru4 122.2(3) . .
C8 Ru3 Ru4 116.8(3) . .
C9 Ru3 Ru4 48.7(3) . .
C6 Ru3 Ru4 137.0(3) . .
Te Ru3 Ru4 58.52(4) . .
Ru5 Ru3 Ru4 60.42(5) . .
Ru2 Ru3 Ru4 92.84(5) . .
C10 Ru4 C11 94.4(4) . .
C10 Ru4 C9 86.9(5) . .
C11 Ru4 C9 90.1(4) . .
C10 Ru4 C3 83.8(4) . .
C11 Ru4 C3 95.3(4) . .
C9 Ru4 C3 169.6(4) . .
C10 Ru4 Te 175.0(4) . .
C11 Ru4 Te 88.3(3) . .
C9 Ru4 Te 97.3(3) . .
C3 Ru4 Te 91.8(3) . .
C10 Ru4 Ru1 117.1(4) . .
C11 Ru4 Ru1 119.2(3) . .
C9 Ru4 Ru1 138.1(3) . .
C3 Ru4 Ru1 45.0(3) . .
Te Ru4 Ru1 57.94(6) . .
C10 Ru4 Ru3 123.1(3) . .
C11 Ru4 Ru3 112.9(3) . .
C9 Ru4 Ru3 46.7(3) . .
C3 Ru4 Ru3 137.2(3) . .
Te Ru4 Ru3 59.21(4) . .
Ru1 Ru4 Ru3 92.31(5) . .
C10 Ru4 Ru5 91.3(3) . .
C11 Ru4 Ru5 172.2(3) . .
C9 Ru4 Ru5 85.0(3) . .
C3 Ru4 Ru5 90.5(3) . .
Te Ru4 Ru5 86.41(6) . .
Ru1 Ru4 Ru5 62.13(4) . .
Ru3 Ru4 Ru5 59.47(7) . .
C12 Ru5 C14 90.5(5) . .
C12 Ru5 C13 99.4(5) . .
C14 Ru5 C13 91.3(4) . .
C12 Ru5 Cu2 72.2(3) . 2_575
C14 Ru5 Cu2 156.0(3) . 2_575
C13 Ru5 Cu2 75.8(3) . 2_575
C12 Ru5 Ru3 164.5(4) . .
C14 Ru5 Ru3 86.9(3) . .
C13 Ru5 Ru3 95.9(3) . .
Cu2 Ru5 Ru3 114.15(6) 2_575 .
C12 Ru5 Ru4 104.5(4) . .
C14 Ru5 Ru4 85.2(3) . .
C13 Ru5 Ru4 155.8(3) . .
Cu2 Ru5 Ru4 114.73(5) 2_575 .
Ru3 Ru5 Ru4 60.12(6) . .
C12 Ru5 Ru1 81.3(4) . .
C14 Ru5 Ru1 138.9(3) . .
C13 Ru5 Ru1 129.7(3) . .
Cu2 Ru5 Ru1 56.44(4) 2_575 .
Ru3 Ru5 Ru1 90.63(7) . .
Ru4 Ru5 Ru1 58.65(4) . .
C12 Ru5 Ru2 127.1(3) . .
C14 Ru5 Ru2 141.9(3) . .
C13 Ru5 Ru2 78.0(3) . .
Cu2 Ru5 Ru2 55.75(7) 2_575 .
Ru3 Ru5 Ru2 58.60(5) . .
Ru4 Ru5 Ru2 90.09(6) . .
Ru1 Ru5 Ru2 63.47(4) . .
Ru2 Te Ru1 70.03(7) . .
Ru2 Te Ru4 98.20(6) . .
Ru1 Te Ru4 62.80(5) . .
Ru2 Te Ru3 62.48(4) . .
Ru1 Te Ru3 97.16(7) . .
Ru4 Te Ru3 62.27(4) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.144(12) .
C1 Ru1 1.877(10) .
C1 Cu2 2.537(10) 2_575
C2 O2 1.145(11) .
C2 Ru1 1.889(10) .
C3 O3 1.163(12) .
C3 Ru1 1.995(10) .
C3 Ru4 2.161(11) .
C4 O4 1.140(12) .
C4 Ru2 1.883(11) .
C4 Cu2 2.485(11) 2_575
C5 O5 1.132(11) .
C5 Ru2 1.900(10) .
C6 O6 1.153(11) .
C6 Ru2 1.991(10) .
C6 Ru3 2.200(10) .
C7 O7 1.145(12) .
C7 Ru3 1.860(11) .
C8 O8 1.100(11) .
C8 Ru3 1.940(11) .
C9 O9 1.138(11) .
C9 Ru3 2.060(10) .
C9 Ru4 2.125(11) .
C10 O10 1.167(13) .
C10 Ru4 1.863(11) .
C11 O11 1.123(11) .
C11 Ru4 1.907(10) .
C12 O12 1.171(12) .
C12 Ru5 1.867(11) .
C13 O13 1.130(12) .
C13 Ru5 1.919(11) .
C14 O14 1.139(11) .
C14 Ru5 1.883(10) .
C15 C20 1.387(12) .
C15 C16 1.392(13) .
C15 P 1.791(9) .
C16 C17 1.379(14) .
C16 H16 0.9300 .
C17 C18 1.364(15) .
C17 H17 0.9300 .
C18 C19 1.350(15) .
C18 H18 0.9300 .
C19 C20 1.372(13) .
C19 H19 0.9300 .
C20 H20 0.9300 .
C21 C22 1.383(14) .
C21 C26 1.384(13) .
C21 P 1.793(9) .
C22 C23 1.366(15) .
C22 H22 0.9300 .
C23 C24 1.357(16) .
C23 H23 0.9300 .
C24 C25 1.375(17) .
C24 H24 0.9300 .
C25 C26 1.361(15) .
C25 H25 0.9300 .
C26 H26 0.9300 .
C27 C28 1.367(14) .
C27 C32 1.384(14) .
C27 P 1.801(10) .
C28 C29 1.390(15) .
C28 H28 0.9300 .
C29 C30 1.329(18) .
C29 H29 0.9300 .
C30 C31 1.412(18) .
C30 H30 0.9300 .
C31 C32 1.340(15) .
C31 H31 0.9300 .
C32 H32 0.9300 .
C33 C34 1.374(14) .
C33 C38 1.390(14) .
C33 P 1.790(10) .
C34 C35 1.380(15) .
C34 H34 0.9300 .
C35 C36 1.371(18) .
C35 H35 0.9300 .
C36 C37 1.349(19) .
C36 H36 0.9300 .
C37 C38 1.374(16) .
C37 H37 0.9300 .
C38 H38 0.9300 .
Br Cu1 2.3240(19) .
Br Cu2 2.331(3) .
Cu1 Cu2 2.598(3) 2_575
Cu1 Ru2 2.6167(18) .
Cu1 Ru1 2.6364(15) .
Cu1 Cu2 2.773(2) .
Cu2 C4 2.485(11) 2_575
Cu2 C1 2.537(10) 2_575
Cu2 Cu1 2.598(3) 2_575
Cu2 Ru2 2.633(3) 2_575
Cu2 Ru1 2.651(2) 2_575
Cu2 Ru5 2.6824(17) 2_575
Ru1 Cu2 2.651(2) 2_575
Ru1 Te 2.677(3) .
Ru1 Ru4 2.8094(16) .
Ru1 Ru5 2.9080(13) .
Ru1 Ru2 3.0706(17) .
Ru2 Cu2 2.633(3) 2_575
Ru2 Te 2.6745(17) .
Ru2 Ru3 2.8058(15) .
Ru2 Ru5 2.9293(19) .
Ru3 Te 2.7350(12) .
Ru3 Ru5 2.800(4) .
Ru3 Ru4 2.8182(16) .
Ru4 Te 2.7152(15) .
Ru4 Ru5 2.827(2) .
Ru5 Cu2 2.6824(17) 2_575
