# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2015

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

data_1

_database_code_depnum_ccdc_archive 'CCDC 1029048'
_audit_update_record             
;
2015-02-17 deposited with the CCDC.
2015-02-26 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C76 H40 Cl Cu3 O28 P2 Ru10 Te2'
_chemical_formula_sum            'C76 H40 Cl Cu3 O28 P2 Ru10 Te2'
_chemical_formula_weight         2954.99

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'
O O 0.0106 0.0060 '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'
Ru Ru -1.2594 0.8363 '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'
Cl Cl 0.1484 0.1585 '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'
K K 0.2009 0.2494 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 21/n'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   24.3922(6)
_cell_length_b                   14.7256(3)
_cell_length_c                   25.7278(7)
_cell_angle_alpha                90.00
_cell_angle_beta                 110.132(1)
_cell_angle_gamma                90.00
_cell_volume                     8676.8(4)
_cell_formula_units_Z            4
_cell_measurement_temperature    298(2)
_cell_measurement_reflns_used    209946
_cell_measurement_theta_min      2.037
_cell_measurement_theta_max      25.028

_exptl_crystal_description       prism
_exptl_crystal_colour            black
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.17
_exptl_crystal_size_min          0.04
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.262
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             5592
_exptl_absorpt_coefficient_mu    3.207
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6128
_exptl_absorpt_correction_T_max  0.7248
_exptl_absorpt_process_details   'SADABS, 2003'

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      298(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       'CCD rotation images, thick slices'
_diffrn_detector_area_resol_mean 9
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            82708
_diffrn_reflns_av_R_equivalents  0.1771
_diffrn_reflns_av_unetI/netI     0.1558
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_h_max       29
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_theta_min         2.12
_diffrn_reflns_theta_max         25.00
_reflns_number_total             15086
_reflns_number_gt                8282
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Collect (Nonius BV, 1997-2000)'
_computing_cell_refinement       'HKL Scalepack (Otwinowski & Minor 1997)'
_computing_data_reduction        'HKL Denzo and Scalepack'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1986)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (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. The following restraint
 command was applied.
 DELU 0.0002 c56 c57
 SIMU 0.0002 c56 c57
 DELU 0.0002 c69 c70
 SIMU 0.0002 c69 c70
;

_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)+(0.0674P)²+198.7322P] 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         15086
_refine_ls_number_parameters     1108
_refine_ls_number_restraints     14
_refine_ls_R_factor_all          0.1809
_refine_ls_R_factor_gt           0.0913
_refine_ls_wR_factor_ref         0.2313
_refine_ls_wR_factor_gt          0.1901
_refine_ls_goodness_of_fit_ref   1.112
_refine_ls_restrained_S_all      1.112
_refine_ls_shift/su_max          0.030
_refine_ls_shift/su_mean         0.001

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 0.3355(11) 0.3147(18) -0.1328(10) 0.064(7) Uani 1 1 d . . .
C2 C 0.2796(11) 0.2475(18) -0.2379(8) 0.056(6) Uani 1 1 d . . .
C3 C 0.3020(10) 0.4285(17) -0.2284(10) 0.056(6) Uani 1 1 d . . .
C4 C 0.1880(9) 0.3660(16) -0.2775(12) 0.057(6) Uani 1 1 d . . .
C5 C 0.1096(10) 0.505(2) -0.2513(11) 0.080(9) Uani 1 1 d . . .
C6 C 0.0778(12) 0.3278(16) -0.2799(11) 0.065(7) Uani 1 1 d . . .
C7 C 0.0805(11) 0.3804(15) -0.1764(9) 0.056(6) Uani 1 1 d . . .
C8 C 0.1002(10) 0.2759(16) -0.0899(8) 0.051(6) Uani 1 1 d . . .
C9 C 0.1341(9) 0.4504(18) -0.0705(8) 0.048(6) Uani 1 1 d . . .
C10 C 0.3346(10) 0.3855(16) -0.0340(9) 0.053(6) Uani 1 1 d . . .
C11 C 0.3140(10) 0.2006(16) -0.0534(8) 0.045(6) Uani 1 1 d . . .
C12 C 0.2464(11) 0.1202(16) -0.1589(10) 0.058(6) Uani 1 1 d . . .
C13 C 0.1347(9) 0.1349(15) -0.1527(9) 0.047(5) Uani 1 1 d . . .
C14 C 0.1572(14) 0.179(2) -0.2481(11) 0.082(9) Uani 1 1 d . . .
C15 C 0.1728(9) 0.3502(14) 0.0542(7) 0.039(5) Uani 1 1 d . . .
C16 C 0.2569(8) 0.4726(14) 0.0499(8) 0.040(5) Uani 1 1 d . . .
C17 C 0.2229(11) 0.4548(17) 0.1440(9) 0.060(6) Uani 1 1 d . . .
C18 C 0.3282(9) 0.5072(17) 0.2447(9) 0.055(6) Uani 1 1 d . . .
C19 C 0.2391(9) 0.3882(16) 0.2469(8) 0.050(6) Uani 1 1 d . . .
C20 C 0.3518(9) 0.3276(14) 0.2827(9) 0.045(5) Uani 1 1 d . . .
C21 C 0.4586(12) 0.2913(17) 0.2585(11) 0.069(7) Uani 1 1 d . . .
C22 C 0.3884(11) 0.1550(16) 0.2766(9) 0.055(6) Uani 1 1 d . . .
C23 C 0.3950(10) 0.1479(16) 0.1754(9) 0.049(6) Uani 1 1 d . . .
C24 C 0.3212(9) 0.1093(17) 0.0703(10) 0.048(6) Uani 1 1 d . . .
C25 C 0.4032(9) 0.2378(13) 0.0773(10) 0.049(6) Uani 1 1 d . . .
C26 C 0.2666(8) 0.1905(15) 0.2434(9) 0.046(6) Uani 1 1 d . . .
C27 C 0.1766(10) 0.2409(16) 0.1446(11) 0.060(7) Uani 1 1 d . . .
C28 C 0.2498(11) 0.0955(17) 0.1459(10) 0.060(7) Uani 1 1 d . . .
C29 C 0.4917(8) 0.3866(13) 0.5831(9) 0.044(5) Uani 1 1 d . . .
C30 C 0.4888(9) 0.4646(17) 0.6111(10) 0.060(7) Uani 1 1 d . . .
H30 H 0.4638 0.4661 0.6314 0.072 Uiso 1 1 calc R . .
C31 C 0.5208(10) 0.5397(16) 0.6104(10) 0.059(6) Uani 1 1 d . . .
H31 H 0.5182 0.5918 0.6299 0.070 Uiso 1 1 calc R . .
C32 C 0.5577(11) 0.5358(17) 0.5794(11) 0.072(8) Uani 1 1 d . . .
H32 H 0.5799 0.5866 0.5782 0.086 Uiso 1 1 calc R . .
C33 C 0.5622(10) 0.4590(17) 0.5505(12) 0.074(8) Uani 1 1 d . . .
H33 H 0.5873 0.4579 0.5303 0.088 Uiso 1 1 calc R . .
C34 C 0.5287(9) 0.3837(13) 0.5519(9) 0.047(5) Uani 1 1 d . . .
H34 H 0.5308 0.3316 0.5322 0.056 Uiso 1 1 calc R . .
C35 C 0.4975(8) 0.2254(15) 0.6526(8) 0.048(6) Uani 1 1 d . . .
C36 C 0.4920(10) 0.1361(16) 0.6603(11) 0.063(7) Uani 1 1 d . . .
H36 H 0.4644 0.1023 0.6332 0.076 Uiso 1 1 calc R . .
C37 C 0.5248(13) 0.0967(17) 0.7053(14) 0.081(9) Uani 1 1 d . . .
H37 H 0.5198 0.0349 0.7099 0.097 Uiso 1 1 calc R . .
C38 C 0.5678(12) 0.144(2) 0.7476(11) 0.076(8) Uani 1 1 d . . .
H38 H 0.5900 0.1152 0.7801 0.092 Uiso 1 1 calc R . .
C39 C 0.5761(12) 0.234(2) 0.7397(10) 0.072(8) Uani 1 1 d . . .
H39 H 0.6056 0.2666 0.7657 0.086 Uiso 1 1 calc R . .
C40 C 0.5410(9) 0.2734(15) 0.6940(8) 0.045(5) Uani 1 1 d . . .
H40 H 0.5452 0.3353 0.6892 0.054 Uiso 1 1 calc R . .
C41 C 0.3849(9) 0.3105(15) 0.5958(9) 0.047(5) Uani 1 1 d . . .
C42 C 0.3597(11) 0.253(2) 0.6191(9) 0.071(8) Uani 1 1 d . . .
H42 H 0.3797 0.2004 0.6348 0.085 Uiso 1 1 calc R . .
C43 C 0.3032(12) 0.268(2) 0.6214(11) 0.084(9) Uani 1 1 d . . .
H43 H 0.2861 0.2253 0.6379 0.101 Uiso 1 1 calc R . .
C44 C 0.2741(11) 0.346(2) 0.5984(11) 0.071(8) Uani 1 1 d . . .
H44 H 0.2370 0.3576 0.5994 0.085 Uiso 1 1 calc R . .
C45 C 0.3001(12) 0.4059(18) 0.5745(13) 0.082(9) Uani 1 1 d . . .
H45 H 0.2813 0.4600 0.5600 0.099 Uiso 1 1 calc R . .
C46 C 0.3531(9) 0.3876(15) 0.5716(9) 0.049(6) Uani 1 1 d . . .
H46 H 0.3690 0.4277 0.5528 0.059 Uiso 1 1 calc R . .
C47 C 0.4451(8) 0.2090(13) 0.5335(8) 0.038(5) Uani 1 1 d . . .
C48 C 0.3928(9) 0.2082(15) 0.4912(10) 0.053(6) Uani 1 1 d . . .
H48 H 0.3618 0.2421 0.4941 0.063 Uiso 1 1 calc R . .
C49 C 0.3850(10) 0.1562(16) 0.4426(10) 0.064(7) Uani 1 1 d . . .
H49 H 0.3493 0.1549 0.4138 0.076 Uiso 1 1 calc R . .
C50 C 0.4318(11) 0.1080(16) 0.4396(9) 0.060(6) Uani 1 1 d . . .
H50 H 0.4270 0.0723 0.4086 0.072 Uiso 1 1 calc R . .
C51 C 0.4873(11) 0.1103(16) 0.4820(10) 0.066(7) Uani 1 1 d . . .
H51 H 0.5190 0.0794 0.4783 0.079 Uiso 1 1 calc R . .
C52 C 0.4928(9) 0.1594(15) 0.5287(10) 0.058(6) Uani 1 1 d . . .
H52 H 0.5285 0.1602 0.5576 0.070 Uiso 1 1 calc R . .
C53 C 0.0701(8) 0.1848(14) 0.4840(9) 0.045(5) Uani 1 1 d . . .
C54 C 0.0227(9) 0.1361(17) 0.4926(10) 0.060(6) Uani 1 1 d . . .
H54 H -0.0129 0.1327 0.4638 0.072 Uiso 1 1 calc R . .
C55 C 0.0281(12) 0.0958(17) 0.5406(11) 0.073(8) Uani 1 1 d . . .
H55 H -0.0041 0.0674 0.5449 0.087 Uiso 1 1 calc R . .
C56 C 0.0811(11) 0.0956(18) 0.5843(10) 0.069(5) Uani 1 1 d U . .
H56 H 0.0842 0.0690 0.6180 0.083 Uiso 1 1 calc R . .
C57 C 0.1282(11) 0.1352(18) 0.5766(10) 0.069(5) Uani 1 1 d U . .
H57 H 0.1640 0.1348 0.6054 0.083 Uiso 1 1 calc R . .
C58 C 0.1239(9) 0.1781(17) 0.5245(8) 0.059(7) Uani 1 1 d . . .
H58 H 0.1570 0.2006 0.5188 0.071 Uiso 1 1 calc R . .
C59 C 0.1306(9) 0.2543(16) 0.4117(8) 0.044(5) Uani 1 1 d . . .
C60 C 0.1648(10) 0.3275(17) 0.4370(10) 0.061(7) Uani 1 1 d . . .
H60 H 0.1530 0.3689 0.4583 0.073 Uiso 1 1 calc R . .
C61 C 0.2187(10) 0.3355(19) 0.4287(10) 0.065(7) Uani 1 1 d . . .
H61 H 0.2431 0.3836 0.4453 0.078 Uiso 1 1 calc R . .
C62 C 0.2364(10) 0.2761(18) 0.3975(10) 0.056(6) Uani 1 1 d . . .
H62 H 0.2713 0.2852 0.3912 0.067 Uiso 1 1 calc R . .
C63 C 0.2030(9) 0.2043(16) 0.3760(10) 0.053(6) Uani 1 1 d . . .
H63 H 0.2157 0.1615 0.3561 0.063 Uiso 1 1 calc R . .
C64 C 0.1506(10) 0.1932(14) 0.3828(10) 0.056(6) Uani 1 1 d . . .
H64 H 0.1279 0.1427 0.3675 0.067 Uiso 1 1 calc R . .
C65 C 0.0270(9) 0.3491(14) 0.4223(9) 0.052(6) Uani 1 1 d . . .
C66 C -0.0143(9) 0.3601(16) 0.4461(10) 0.057(6) Uani 1 1 d . . .
H66 H -0.0228 0.3118 0.4654 0.069 Uiso 1 1 calc R . .
C67 C -0.0439(12) 0.4402(18) 0.4426(12) 0.078(8) Uani 1 1 d . . .
H67 H -0.0716 0.4454 0.4599 0.094 Uiso 1 1 calc R . .
C68 C -0.0338(11) 0.5100(18) 0.4152(12) 0.078(8) Uani 1 1 d . . .
H68 H -0.0540 0.5643 0.4131 0.094 Uiso 1 1 calc R . .
C69 C 0.0066(10) 0.5011(17) 0.3902(10) 0.064(5) Uani 1 1 d U . .
H69 H 0.0141 0.5507 0.3713 0.077 Uiso 1 1 calc R . .
C70 C 0.0373(11) 0.4205(16) 0.3916(10) 0.064(5) Uani 1 1 d U . .
H70 H 0.0635 0.4148 0.3727 0.077 Uiso 1 1 calc R . .
C71 C 0.0145(9) 0.1729(19) 0.3614(9) 0.056(6) Uani 1 1 d . . .
C72 C -0.0228(9) 0.2163(16) 0.3165(9) 0.051(6) Uani 1 1 d . . .
H72 H -0.0273 0.2790 0.3159 0.061 Uiso 1 1 calc R . .
C73 C -0.0541(11) 0.163(3) 0.2711(10) 0.088(10) Uani 1 1 d . . .
H73 H -0.0806 0.1899 0.2400 0.105 Uiso 1 1 calc R . .
C74 C -0.0463(13) 0.070(3) 0.2718(15) 0.089(10) Uani 1 1 d . . .
H74 H -0.0648 0.0355 0.2404 0.106 Uiso 1 1 calc R . .
C75 C -0.0132(11) 0.033(2) 0.3160(12) 0.069(8) Uani 1 1 d . . .
H75 H -0.0111 -0.0301 0.3178 0.083 Uiso 1 1 calc R . .
C76 C 0.0188(11) 0.0818(18) 0.3604(14) 0.077(9) Uani 1 1 d . . .
H76 H 0.0445 0.0519 0.3910 0.093 Uiso 1 1 calc R . .
O1 O 0.3843(7) 0.3005(16) -0.1262(7) 0.100(7) Uani 1 1 d . . .
O2 O 0.2935(10) 0.1863(14) -0.2582(9) 0.104(7) Uani 1 1 d . . .
O3 O 0.3256(8) 0.4784(13) -0.2462(9) 0.093(6) Uani 1 1 d . . .
O4 O 0.1795(7) 0.3664(13) -0.3242(7) 0.075(5) Uani 1 1 d . . .
O5 O 0.0944(8) 0.5728(14) -0.2665(9) 0.095(7) Uani 1 1 d . . .
O6 O 0.0383(8) 0.2943(13) -0.3115(7) 0.077(5) Uani 1 1 d . . .
O7 O 0.0285(6) 0.3888(12) -0.1884(7) 0.066(5) Uani 1 1 d . . .
O8 O 0.0658(7) 0.2380(11) -0.0783(7) 0.065(4) Uani 1 1 d . . .
O9 O 0.1221(8) 0.5089(13) -0.0482(8) 0.089(6) Uani 1 1 d . . .
O10 O 0.3694(7) 0.4298(12) -0.0039(7) 0.071(5) Uani 1 1 d . . .
O11 O 0.3384(7) 0.1366(12) -0.0367(6) 0.064(5) Uani 1 1 d . . .
O12 O 0.2790(8) 0.0654(12) -0.1534(7) 0.078(5) Uani 1 1 d . . .
O13 O 0.1019(7) 0.0808(11) -0.1515(7) 0.069(5) Uani 1 1 d . . .
O14 O 0.1395(10) 0.1573(13) -0.2912(7) 0.102(7) Uani 1 1 d . . .
O15 O 0.1250(7) 0.3459(11) 0.0303(7) 0.067(5) Uani 1 1 d . . .
O16 O 0.2598(7) 0.5337(11) 0.0259(6) 0.062(4) Uani 1 1 d . . .
O17 O 0.1881(8) 0.5073(12) 0.1418(7) 0.083(6) Uani 1 1 d . . .
O18 O 0.3510(7) 0.5691(12) 0.2663(8) 0.078(5) Uani 1 1 d . . .
O19 O 0.2062(7) 0.3891(12) 0.2669(7) 0.072(5) Uani 1 1 d . . .
O20 O 0.3607(6) 0.3271(11) 0.3290(7) 0.061(4) Uani 1 1 d . . .
O21 O 0.5070(7) 0.3165(13) 0.2778(8) 0.082(6) Uani 1 1 d . . .
O22 O 0.3936(8) 0.0943(12) 0.3022(7) 0.074(5) Uani 1 1 d . . .
O23 O 0.4182(8) 0.0761(12) 0.1846(6) 0.071(5) Uani 1 1 d . . .
O24 O 0.3189(7) 0.0389(12) 0.0522(7) 0.064(4) Uani 1 1 d . . .
O25 O 0.4379(7) 0.2406(12) 0.0580(7) 0.067(5) Uani 1 1 d . . .
O26 O 0.2655(7) 0.1677(11) 0.2832(7) 0.067(5) Uani 1 1 d . . .
O27 O 0.1297(7) 0.2516(14) 0.1355(7) 0.082(6) Uani 1 1 d . . .
O28 O 0.2410(10) 0.0189(13) 0.1350(8) 0.098(7) Uani 1 1 d . . .
Te1 Te 0.36772(6) 0.39074(10) 0.15102(6) 0.0451(4) Uani 1 1 d . . .
Te2 Te 0.22482(6) 0.46362(10) -0.13857(6) 0.0470(4) Uani 1 1 d . . .
Ru1 Ru 0.25797(8) 0.34313(13) -0.20284(7) 0.0480(5) Uani 1 1 d . . .
Ru2 Ru 0.13848(7) 0.38226(12) -0.22446(7) 0.0469(5) Uani 1 1 d . . .
Ru3 Ru 0.15001(7) 0.35464(12) -0.11316(7) 0.0421(4) Uani 1 1 d . . .
Ru4 Ru 0.27990(7) 0.31335(12) -0.08863(7) 0.0408(4) Uani 1 1 d . . .
Ru5 Ru 0.18932(7) 0.21446(12) -0.17134(7) 0.0434(4) Uani 1 1 d . . .
Ru6 Ru 0.25336(7) 0.37250(11) 0.09546(7) 0.0393(4) Uani 1 1 d . . .
Ru7 Ru 0.34515(7) 0.22254(11) 0.11138(7) 0.0390(4) Uani 1 1 d . . .
Ru8 Ru 0.37917(7) 0.25383(12) 0.22641(7) 0.0410(4) Uani 1 1 d . . .
Ru9 Ru 0.29602(7) 0.39309(12) 0.21229(7) 0.0417(4) Uani 1 1 d . . .
Ru10 Ru 0.25917(7) 0.21837(11) 0.16669(7) 0.0380(4) Uani 1 1 d . . .
Cu1 Cu 0.20370(11) 0.20557(17) -0.06296(10) 0.0452(6) Uani 1 1 d . . .
Cu2 Cu 0.23148(11) 0.20268(17) 0.05759(10) 0.0443(6) Uani 1 1 d . . .
Cu3 Cu 0.2732(3) 0.3148(5) 0.0094(3) 0.0495(16) Uani 0.67 1 d P . .
Cu3A Cu 0.2468(5) 0.3366(10) -0.0064(6) 0.049(3) Uani 0.33 1 d P . .
Cl1 Cl 0.1801(2) 0.1074(4) -0.0078(2) 0.0514(14) Uani 1 1 d . . .
P1 P 0.4545(2) 0.2840(4) 0.5909(2) 0.0427(13) Uani 1 1 d . . .
P2 P 0.0605(2) 0.2401(4) 0.4200(2) 0.0461(14) 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 O1 1.16(3) . ?
C1 Ru4 2.05(2) . ?
C1 Ru1 2.16(3) . ?
C2 O2 1.15(3) . ?
C2 Ru1 1.84(2) . ?
C3 O3 1.12(2) . ?
C3 Ru1 1.91(2) . ?
C4 O4 1.15(3) . ?
C4 Ru1 2.11(3) . ?
C4 Ru2 2.13(3) . ?
C5 O5 1.08(3) . ?
C5 Ru2 1.98(3) . ?
C6 O6 1.14(2) . ?
C6 Ru2 1.85(2) . ?
C7 O7 1.20(3) . ?
C7 Ru3 1.94(2) . ?
C7 Ru2 2.18(2) . ?
C8 O8 1.13(2) . ?
C8 Ru3 1.92(2) . ?
C9 O9 1.13(3) . ?
C9 Ru3 1.91(3) . ?
C10 O10 1.14(2) . ?
C10 Ru4 1.90(2) . ?
C10 Cu3 2.39(2) . ?
C11 O11 1.12(2) . ?
C11 Ru4 1.94(2) . ?
C12 O12 1.11(2) . ?
C12 Ru5 1.91(2) . ?
C13 O13 1.14(2) . ?
C13 Ru5 1.95(2) . ?
C14 O14 1.09(3) . ?
C14 Ru5 1.93(3) . ?
C15 O15 1.12(2) . ?
C15 Ru6 1.91(2) . ?
C16 O16 1.11(2) . ?
C16 Ru6 1.90(2) . ?
C16 Cu3A 2.43(3) . ?
C17 O17 1.14(3) . ?
C17 Ru6 2.05(3) . ?
C17 Ru9 2.22(3) . ?
C18 O18 1.11(2) . ?
C18 Ru9 1.92(2) . ?
C19 O19 1.09(2) . ?
C19 Ru9 1.89(2) . ?
C20 O20 1.13(2) . ?
C20 Ru9 2.09(2) . ?
C20 Ru8 2.09(2) . ?
C21 O21 1.17(3) . ?
C21 Ru8 1.91(3) . ?
C22 O22 1.09(2) . ?
C22 Ru8 1.91(2) . ?
C23 O23 1.18(2) . ?
C23 Ru7 2.01(2) . ?
C23 Ru8 2.16(2) . ?
C24 O24 1.13(2) . ?
C24 Ru7 1.95(3) . ?
C24 Cu2 2.51(2) . ?
C25 O25 1.12(2) . ?
C25 Ru7 1.92(3) . ?
C26 O26 1.09(2) . ?
C26 Ru10 1.96(2) . ?
C27 O27 1.10(2) . ?
C27 Ru10 1.92(2) . ?
C28 O28 1.16(3) . ?
C28 Ru10 1.88(3) . ?
C29 C30 1.37(3) . ?
C29 C34 1.40(3) . ?
C29 P1 1.809(19) . ?
C30 C31 1.36(3) . ?
C30 H30 0.9300 . ?
C31 C32 1.39(3) . ?
C31 H31 0.9300 . ?
C32 C33 1.38(3) . ?
C32 H32 0.9300 . ?
C33 C34 1.39(3) . ?
C33 H33 0.9300 . ?
C34 H34 0.9300 . ?
C35 C36 1.34(3) . ?
C35 C40 1.41(3) . ?
C35 P1 1.79(2) . ?
C36 C37 1.30(3) . ?
C36 H36 0.9300 . ?
C37 C38 1.41(4) . ?
C37 H37 0.9300 . ?
C38 C39 1.36(4) . ?
C38 H38 0.9300 . ?
C39 C40 1.33(3) . ?
C39 H39 0.9300 . ?
C40 H40 0.9300 . ?
C41 C42 1.31(3) . ?
C41 C46 1.39(3) . ?
C41 P1 1.79(2) . ?
C42 C43 1.42(3) . ?
C42 H42 0.9300 . ?
C43 C44 1.38(4) . ?
C43 H43 0.9300 . ?
C44 C45 1.35(3) . ?
C44 H44 0.9300 . ?
C45 C46 1.35(3) . ?
C45 H45 0.9300 . ?
C46 H46 0.9300 . ?
C47 C48 1.36(3) . ?
C47 C52 1.42(3) . ?
C47 P1 1.794(19) . ?
C48 C49 1.42(3) . ?
C48 H48 0.9300 . ?
C49 C50 1.37(3) . ?
C49 H49 0.9300 . ?
C50 C51 1.42(3) . ?
C50 H50 0.9300 . ?
C51 C52 1.37(3) . ?
C51 H51 0.9300 . ?
C52 H52 0.9300 . ?
C53 C58 1.37(3) . ?
C53 C54 1.44(3) . ?
C53 P2 1.78(2) . ?
C54 C55 1.33(3) . ?
C54 H54 0.9300 . ?
C55 C56 1.39(3) . ?
C55 H55 0.9300 . ?
C56 C57 1.36(3) . ?
C56 H56 0.9300 . ?
C57 C58 1.45(3) . ?
C57 H57 0.9300 . ?
C58 H58 0.9300 . ?
C59 C64 1.36(3) . ?
C59 C60 1.38(3) . ?
C59 P2 1.81(2) . ?
C60 C61 1.41(3) . ?
C60 H60 0.9300 . ?
C61 C62 1.36(3) . ?
C61 H61 0.9300 . ?
C62 C63 1.33(3) . ?
C62 H62 0.9300 . ?
C63 C64 1.36(3) . ?
C63 H63 0.9300 . ?
C64 H64 0.9300 . ?
C65 C66 1.36(3) . ?
C65 C70 1.39(3) . ?
C65 P2 1.81(2) . ?
C66 C67 1.37(3) . ?
C66 H66 0.9300 . ?
C67 C68 1.32(3) . ?
C67 H67 0.9300 . ?
C68 C69 1.36(3) . ?
C68 H68 0.9300 . ?
C69 C70 1.40(3) . ?
C69 H69 0.9300 . ?
C70 H70 0.9300 . ?
C71 C76 1.35(3) . ?
C71 C72 1.36(3) . ?
C71 P2 1.83(2) . ?
C72 C73 1.40(4) . ?
C72 H72 0.9300 . ?
C73 C74 1.37(4) . ?
C73 H73 0.9300 . ?
C74 C75 1.27(4) . ?
C74 H74 0.9300 . ?
C75 C76 1.35(3) . ?
C75 H75 0.9300 . ?
C76 H76 0.9300 . ?
Te1 Ru7 2.663(2) . ?
Te1 Ru6 2.674(2) . ?
Te1 Ru9 2.728(2) . ?
Te1 Ru8 2.744(2) . ?
Te2 Ru3 2.675(2) . ?
Te2 Ru4 2.677(2) . ?
Te2 Ru1 2.731(2) . ?
Te2 Ru2 2.748(2) . ?
Ru1 Ru5 2.826(2) . ?
Ru1 Ru2 2.832(2) . ?
Ru1 Ru4 2.834(2) . ?
Ru2 Ru3 2.809(2) . ?
Ru2 Ru5 2.889(2) . ?
Ru3 Cu1 2.653(3) . ?
Ru3 Ru5 2.900(2) . ?
Ru3 Cu3A 2.953(13) . ?
Ru3 Ru4 3.071(2) . ?
Ru4 Cu3A 2.533(16) . ?
Ru4 Cu3 2.583(7) . ?
Ru4 Cu1 2.693(3) . ?
Ru4 Ru5 2.880(2) . ?
Ru5 Cu1 2.691(3) . ?
Ru6 Cu3 2.568(7) . ?
Ru6 Cu3A 2.625(16) . ?
Ru6 Cu2 2.670(3) . ?
Ru6 Ru9 2.839(2) . ?
Ru6 Ru10 2.890(2) . ?
Ru6 Ru7 3.070(2) . ?
Ru7 Cu2 2.655(3) . ?
Ru7 Ru8 2.823(2) . ?
Ru7 Ru10 2.912(2) . ?
Ru7 Cu3 2.939(7) . ?
Ru8 Ru9 2.819(2) . ?
Ru8 Ru10 2.847(2) . ?
Ru9 Ru10 2.842(2) . ?
Ru10 Cu2 2.661(3) . ?
Cu1 Cl1 2.235(6) . ?
Cu1 Cu3A 2.427(16) . ?
Cu1 Cu3 2.600(7) . ?
Cu1 Cu2 2.938(4) . ?
Cu2 Cl1 2.218(6) . ?
Cu2 Cu3 2.484(8) . ?
Cu2 Cu3A 2.677(15) . ?
Cu3 Cu3A 0.710(10) . ?

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
O1 C1 Ru4 139(2) . . ?
O1 C1 Ru1 135.7(19) . . ?
Ru4 C1 Ru1 84.7(9) . . ?
O2 C2 Ru1 178(2) . . ?
O3 C3 Ru1 176(2) . . ?
O4 C4 Ru1 138.7(19) . . ?
O4 C4 Ru2 137.3(18) . . ?
Ru1 C4 Ru2 83.9(11) . . ?
O5 C5 Ru2 179(3) . . ?
O6 C6 Ru2 175(2) . . ?
O7 C7 Ru3 140.9(19) . . ?
O7 C7 Ru2 133.2(17) . . ?
Ru3 C7 Ru2 85.8(10) . . ?
O8 C8 Ru3 171(2) . . ?
O9 C9 Ru3 176(2) . . ?
O10 C10 Ru4 175(2) . . ?
O10 C10 Cu3 111.9(17) . . ?
Ru4 C10 Cu3 73.1(8) . . ?
O11 C11 Ru4 171.1(17) . . ?
O12 C12 Ru5 178(2) . . ?
O13 C13 Ru5 166(2) . . ?
O14 C14 Ru5 178(3) . . ?
O15 C15 Ru6 173.3(19) . . ?
O16 C16 Ru6 176.2(18) . . ?
O16 C16 Cu3A 110.4(16) . . ?
Ru6 C16 Cu3A 73.3(8) . . ?
O17 C17 Ru6 142(2) . . ?
O17 C17 Ru9 134.5(19) . . ?
Ru6 C17 Ru9 83.1(10) . . ?
O18 C18 Ru9 174(2) . . ?
O19 C19 Ru9 177(2) . . ?
O20 C20 Ru9 138.1(17) . . ?
O20 C20 Ru8 137.0(16) . . ?
Ru9 C20 Ru8 84.7(8) . . ?
O21 C21 Ru8 178(2) . . ?
O22 C22 Ru8 175(2) . . ?
O23 C23 Ru7 140.0(17) . . ?
O23 C23 Ru8 134.2(16) . . ?
Ru7 C23 Ru8 85.3(9) . . ?
O24 C24 Ru7 165.8(19) . . ?
O24 C24 Cu2 122.1(17) . . ?
Ru7 C24 Cu2 71.8(8) . . ?
O25 C25 Ru7 175.3(18) . . ?
O26 C26 Ru10 171(2) . . ?
O27 C27 Ru10 175(2) . . ?
O28 C28 Ru10 175(2) . . ?
C30 C29 C34 119.1(18) . . ?
C30 C29 P1 121.5(17) . . ?
C34 C29 P1 119.1(16) . . ?
C31 C30 C29 123(2) . . ?
C31 C30 H30 118.6 . . ?
C29 C30 H30 118.6 . . ?
C30 C31 C32 117(2) . . ?
C30 C31 H31 121.3 . . ?
C32 C31 H31 121.3 . . ?
C33 C32 C31 122(2) . . ?
C33 C32 H32 119.0 . . ?
C31 C32 H32 119.0 . . ?
C32 C33 C34 119(2) . . ?
C32 C33 H33 120.5 . . ?
C34 C33 H33 120.5 . . ?
C33 C34 C29 120(2) . . ?
C33 C34 H34 120.2 . . ?
C29 C34 H34 120.2 . . ?
C36 C35 C40 118(2) . . ?
C36 C35 P1 122.9(16) . . ?
C40 C35 P1 119.2(17) . . ?
C37 C36 C35 121(2) . . ?
C37 C36 H36 119.7 . . ?
C35 C36 H36 119.7 . . ?
C36 C37 C38 122(3) . . ?
C36 C37 H37 118.9 . . ?
C38 C37 H37 118.9 . . ?
C39 C38 C37 118(3) . . ?
C39 C38 H38 120.8 . . ?
C37 C38 H38 120.8 . . ?
C40 C39 C38 118(3) . . ?
C40 C39 H39 120.9 . . ?
C38 C39 H39 120.9 . . ?
C39 C40 C35 123(2) . . ?
C39 C40 H40 118.7 . . ?
C35 C40 H40 118.7 . . ?
C42 C41 C46 117(2) . . ?
C42 C41 P1 120(2) . . ?
C46 C41 P1 122.8(16) . . ?
C41 C42 C43 123(3) . . ?
C41 C42 H42 118.7 . . ?
C43 C42 H42 118.7 . . ?
C44 C43 C42 118(3) . . ?
C44 C43 H43 120.8 . . ?
C42 C43 H43 120.8 . . ?
C45 C44 C43 119(2) . . ?
C45 C44 H44 120.3 . . ?
C43 C44 H44 120.3 . . ?
C46 C45 C44 120(2) . . ?
C46 C45 H45 119.9 . . ?
C44 C45 H45 119.9 . . ?
C45 C46 C41 122(2) . . ?
C45 C46 H46 118.8 . . ?
C41 C46 H46 118.8 . . ?
C48 C47 C52 119.8(19) . . ?
C48 C47 P1 118.8(16) . . ?
C52 C47 P1 121.0(16) . . ?
C47 C48 C49 121(2) . . ?
C47 C48 H48 119.6 . . ?
C49 C48 H48 119.6 . . ?
C50 C49 C48 118(2) . . ?
C50 C49 H49 121.1 . . ?
C48 C49 H49 121.1 . . ?
C49 C50 C51 123(2) . . ?
C49 C50 H50 118.7 . . ?
C51 C50 H50 118.7 . . ?
C52 C51 C50 118(2) . . ?
C52 C51 H51 121.0 . . ?
C50 C51 H51 121.0 . . ?
C51 C52 C47 121(2) . . ?
C51 C52 H52 119.5 . . ?
C47 C52 H52 119.5 . . ?
C58 C53 C54 117(2) . . ?
C58 C53 P2 121.6(16) . . ?
C54 C53 P2 120.9(16) . . ?
C55 C54 C53 122(2) . . ?
C55 C54 H54 118.8 . . ?
C53 C54 H54 118.8 . . ?
C54 C55 C56 121(2) . . ?
C54 C55 H55 119.4 . . ?
C56 C55 H55 119.4 . . ?
C57 C56 C55 118(2) . . ?
C57 C56 H56 120.8 . . ?
C55 C56 H56 120.8 . . ?
C56 C57 C58 122(2) . . ?
C56 C57 H57 119.2 . . ?
C58 C57 H57 119.2 . . ?
C53 C58 C57 119(2) . . ?
C53 C58 H58 120.6 . . ?
C57 C58 H58 120.6 . . ?
C64 C59 C60 120(2) . . ?
C64 C59 P2 121.3(18) . . ?
C60 C59 P2 118.5(17) . . ?
C59 C60 C61 116(2) . . ?
C59 C60 H60 122.0 . . ?
C61 C60 H60 122.0 . . ?
C62 C61 C60 123(2) . . ?
C62 C61 H61 118.6 . . ?
C60 C61 H61 118.6 . . ?
C63 C62 C61 119(2) . . ?
C63 C62 H62 120.5 . . ?
C61 C62 H62 120.5 . . ?
C62 C63 C64 121(2) . . ?
C62 C63 H63 119.7 . . ?
C64 C63 H63 119.7 . . ?
C63 C64 C59 121(2) . . ?
C63 C64 H64 119.3 . . ?
C59 C64 H64 119.3 . . ?
C66 C65 C70 118(2) . . ?
C66 C65 P2 122.2(17) . . ?
C70 C65 P2 118.6(17) . . ?
C65 C66 C67 122(2) . . ?
C65 C66 H66 119.1 . . ?
C67 C66 H66 119.1 . . ?
C68 C67 C66 121(2) . . ?
C68 C67 H67 119.4 . . ?
C66 C67 H67 119.4 . . ?
C67 C68 C69 119(2) . . ?
C67 C68 H68 120.7 . . ?
C69 C68 H68 120.7 . . ?
C68 C69 C70 123(2) . . ?
C68 C69 H69 118.7 . . ?
C70 C69 H69 118.7 . . ?
C65 C70 C69 117(2) . . ?
C65 C70 H70 121.4 . . ?
C69 C70 H70 121.4 . . ?
C76 C71 C72 119(2) . . ?
C76 C71 P2 122(2) . . ?
C72 C71 P2 119(2) . . ?
C71 C72 C73 117(3) . . ?
C71 C72 H72 121.4 . . ?
C73 C72 H72 121.4 . . ?
C74 C73 C72 121(3) . . ?
C74 C73 H73 119.5 . . ?
C72 C73 H73 119.5 . . ?
C75 C74 C73 119(3) . . ?
C75 C74 H74 120.6 . . ?
C73 C74 H74 120.6 . . ?
C74 C75 C76 122(3) . . ?
C74 C75 H75 118.9 . . ?
C76 C75 H75 118.9 . . ?
C75 C76 C71 121(3) . . ?
C75 C76 H76 119.3 . . ?
C71 C76 H76 119.3 . . ?
Ru7 Te1 Ru6 70.23(6) . . ?
Ru7 Te1 Ru9 98.28(7) . . ?
Ru6 Te1 Ru9 63.39(6) . . ?
Ru7 Te1 Ru8 62.92(6) . . ?
Ru6 Te1 Ru8 97.92(6) . . ?
Ru9 Te1 Ru8 62.00(6) . . ?
Ru3 Te2 Ru4 70.03(6) . . ?
Ru3 Te2 Ru1 97.31(7) . . ?
Ru4 Te2 Ru1 63.21(6) . . ?
Ru3 Te2 Ru2 62.38(6) . . ?
Ru4 Te2 Ru2 98.32(7) . . ?
Ru1 Te2 Ru2 62.25(6) . . ?
C2 Ru1 C3 92.6(10) . . ?
C2 Ru1 C4 87.4(10) . . ?
C3 Ru1 C4 87.5(9) . . ?
C2 Ru1 C1 86.8(10) . . ?
C3 Ru1 C1 88.9(9) . . ?
C4 Ru1 C1 173.0(9) . . ?
C2 Ru1 Te2 170.5(7) . . ?
C3 Ru1 Te2 95.7(7) . . ?
C4 Ru1 Te2 97.6(7) . . ?
C1 Ru1 Te2 88.7(7) . . ?
C2 Ru1 Ru5 85.7(7) . . ?
C3 Ru1 Ru5 176.8(8) . . ?
C4 Ru1 Ru5 89.7(7) . . ?
C1 Ru1 Ru5 93.8(6) . . ?
Te2 Ru1 Ru5 86.21(7) . . ?
C2 Ru1 Ru2 120.5(8) . . ?
C3 Ru1 Ru2 117.4(6) . . ?
C4 Ru1 Ru2 48.3(7) . . ?
C1 Ru1 Ru2 138.6(6) . . ?
Te2 Ru1 Ru2 59.17(6) . . ?
Ru5 Ru1 Ru2 61.40(6) . . ?
C2 Ru1 Ru4 113.9(6) . . ?
C3 Ru1 Ru4 122.0(7) . . ?
C4 Ru1 Ru4 140.6(7) . . ?
C1 Ru1 Ru4 46.0(6) . . ?
Te2 Ru1 Ru4 57.47(6) . . ?
Ru5 Ru1 Ru4 61.17(6) . . ?
Ru2 Ru1 Ru4 92.83(7) . . ?
C6 Ru2 C5 91.9(11) . . ?
C6 Ru2 C4 86.3(11) . . ?
C5 Ru2 C4 95.3(11) . . ?
C6 Ru2 C7 85.9(10) . . ?
C5 Ru2 C7 89.3(11) . . ?
C4 Ru2 C7 171.2(9) . . ?
C6 Ru2 Te2 176.9(8) . . ?
C5 Ru2 Te2 87.9(8) . . ?
C4 Ru2 Te2 96.8(7) . . ?
C7 Ru2 Te2 91.0(6) . . ?
C6 Ru2 Ru3 119.8(8) . . ?
C5 Ru2 Ru3 112.7(9) . . ?
C4 Ru2 Ru3 139.4(7) . . ?
C7 Ru2 Ru3 43.6(6) . . ?
Te2 Ru2 Ru3 57.53(6) . . ?
C6 Ru2 Ru1 124.1(8) . . ?
C5 Ru2 Ru1 118.2(7) . . ?
C4 Ru2 Ru1 47.9(7) . . ?
C7 Ru2 Ru1 135.4(6) . . ?
Te2 Ru2 Ru1 58.57(6) . . ?
Ru3 Ru2 Ru1 92.01(7) . . ?
C6 Ru2 Ru5 95.4(8) . . ?
C5 Ru2 Ru5 172.2(8) . . ?
C4 Ru2 Ru5 87.8(6) . . ?
C7 Ru2 Ru5 88.7(6) . . ?
Te2 Ru2 Ru5 84.67(6) . . ?
Ru3 Ru2 Ru5 61.17(6) . . ?
Ru1 Ru2 Ru5 59.19(6) . . ?
C9 Ru3 C8 89.5(9) . . ?
C9 Ru3 C7 92.6(9) . . ?
C8 Ru3 C7 85.1(9) . . ?
C9 Ru3 Cu1 119.7(6) . . ?
C8 Ru3 Cu1 66.9(7) . . ?
C7 Ru3 Cu1 135.4(7) . . ?
C9 Ru3 Te2 89.4(6) . . ?
C8 Ru3 Te2 176.1(6) . . ?
C7 Ru3 Te2 98.7(7) . . ?
Cu1 Ru3 Te2 110.58(8) . . ?
C9 Ru3 Ru2 120.7(6) . . ?
C8 Ru3 Ru2 123.6(6) . . ?
C7 Ru3 Ru2 50.6(7) . . ?
Cu1 Ru3 Ru2 118.40(9) . . ?
Te2 Ru3 Ru2 60.09(6) . . ?
C9 Ru3 Ru5 172.9(6) . . ?
C8 Ru3 Ru5 95.0(7) . . ?
C7 Ru3 Ru5 93.2(7) . . ?
Cu1 Ru3 Ru5 57.77(7) . . ?
Te2 Ru3 Ru5 85.77(7) . . ?
Ru2 Ru3 Ru5 60.77(6) . . ?
C9 Ru3 Cu3A 77.7(6) . . ?
C8 Ru3 Cu3A 92.6(7) . . ?
C7 Ru3 Cu3A 170.1(7) . . ?
Cu1 Ru3 Cu3A 51.0(3) . . ?
Te2 Ru3 Cu3A 83.5(3) . . ?
Ru2 Ru3 Cu3A 136.7(3) . . ?
Ru5 Ru3 Cu3A 96.6(3) . . ?
C9 Ru3 Ru4 115.4(6) . . ?
C8 Ru3 Ru4 122.4(7) . . ?
C7 Ru3 Ru4 138.9(7) . . ?
Cu1 Ru3 Ru4 55.57(7) . . ?
Te2 Ru3 Ru4 55.01(5) . . ?
Ru2 Ru3 Ru4 88.42(6) . . ?
Ru5 Ru3 Ru4 57.59(6) . . ?
Cu3A Ru3 Ru4 49.7(3) . . ?
C10 Ru4 C11 93.1(10) . . ?
C10 Ru4 C1 88.6(10) . . ?
C11 Ru4 C1 90.5(9) . . ?
C10 Ru4 Cu3A 69.5(7) . . ?
C11 Ru4 Cu3A 86.2(6) . . ?
C1 Ru4 Cu3A 157.6(8) . . ?
C10 Ru4 Cu3 62.3(7) . . ?
C11 Ru4 Cu3 73.2(5) . . ?
C1 Ru4 Cu3 144.9(7) . . ?
Cu3A Ru4 Cu3 15.9(2) . . ?
C10 Ru4 Te2 90.1(7) . . ?
C11 Ru4 Te2 175.6(7) . . ?
C1 Ru4 Te2 92.6(7) . . ?
Cu3A Ru4 Te2 92.1(3) . . ?
Cu3 Ru4 Te2 105.78(16) . . ?
C10 Ru4 Cu1 121.1(7) . . ?
C11 Ru4 Cu1 66.5(6) . . ?
C1 Ru4 Cu1 141.9(7) . . ?
Cu3A Ru4 Cu1 55.2(3) . . ?
Cu3 Ru4 Cu1 59.00(17) . . ?
Te2 Ru4 Cu1 109.28(8) . . ?
C10 Ru4 Ru1 121.1(7) . . ?
C11 Ru4 Ru1 121.0(5) . . ?
C1 Ru4 Ru1 49.3(7) . . ?
Cu3A Ru4 Ru1 147.6(3) . . ?
Cu3 Ru4 Ru1 163.42(16) . . ?
Te2 Ru4 Ru1 59.33(6) . . ?
Cu1 Ru4 Ru1 116.46(9) . . ?
C10 Ru4 Ru5 175.1(7) . . ?
C11 Ru4 Ru5 90.5(7) . . ?
C1 Ru4 Ru5 94.7(7) . . ?
Cu3A Ru4 Ru5 107.5(3) . . ?
Cu3 Ru4 Ru5 115.84(16) . . ?
Te2 Ru4 Ru5 86.14(7) . . ?
Cu1 Ru4 Ru5 57.63(7) . . ?
Ru1 Ru4 Ru5 59.27(6) . . ?
C10 Ru4 Ru3 117.0(7) . . ?
C11 Ru4 Ru3 120.8(6) . . ?
C1 Ru4 Ru3 135.9(7) . . ?
Cu3A Ru4 Ru3 62.7(3) . . ?
Cu3 Ru4 Ru3 77.98(15) . . ?
Te2 Ru4 Ru3 54.96(5) . . ?
Cu1 Ru4 Ru3 54.33(7) . . ?
Ru1 Ru4 Ru3 86.74(6) . . ?
Ru5 Ru4 Ru3 58.22(6) . . ?
C12 Ru5 C14 89.5(11) . . ?
C12 Ru5 C13 92.4(9) . . ?
C14 Ru5 C13 91.1(11) . . ?
C12 Ru5 Cu1 87.9(7) . . ?
C14 Ru5 Cu1 155.5(9) . . ?
C13 Ru5 Cu1 64.7(7) . . ?
C12 Ru5 Ru1 93.7(7) . . ?
C14 Ru5 Ru1 87.7(9) . . ?
C13 Ru5 Ru1 173.7(6) . . ?
Cu1 Ru5 Ru1 116.81(9) . . ?
C12 Ru5 Ru4 85.1(7) . . ?
C14 Ru5 Ru4 146.2(9) . . ?
C13 Ru5 Ru4 122.4(7) . . ?
Cu1 Ru5 Ru4 57.71(7) . . ?
Ru1 Ru5 Ru4 59.55(6) . . ?
C12 Ru5 Ru2 150.3(7) . . ?
C14 Ru5 Ru2 77.8(8) . . ?
C13 Ru5 Ru2 114.3(6) . . ?
Cu1 Ru5 Ru2 114.42(9) . . ?
Ru1 Ru5 Ru2 59.41(6) . . ?
Ru4 Ru5 Ru2 90.71(7) . . ?
C12 Ru5 Ru3 141.4(7) . . ?
C14 Ru5 Ru3 129.1(9) . . ?
C13 Ru5 Ru3 85.7(6) . . ?
Cu1 Ru5 Ru3 56.50(7) . . ?
Ru1 Ru5 Ru3 90.26(7) . . ?
Ru4 Ru5 Ru3 64.18(6) . . ?
Ru2 Ru5 Ru3 58.06(6) . . ?
C16 Ru6 C15 92.7(8) . . ?
C16 Ru6 C17 91.1(9) . . ?
C15 Ru6 C17 85.5(9) . . ?
C16 Ru6 Cu3 70.3(6) . . ?
C15 Ru6 Cu3 85.8(6) . . ?
C17 Ru6 Cu3 159.1(7) . . ?
C16 Ru6 Cu3A 62.7(7) . . ?
C15 Ru6 Cu3A 73.3(6) . . ?
C17 Ru6 Cu3A 144.7(7) . . ?
Cu3 Ru6 Cu3A 15.7(2) . . ?
C16 Ru6 Cu2 123.1(6) . . ?
C15 Ru6 Cu2 66.3(6) . . ?
C17 Ru6 Cu2 134.9(7) . . ?
Cu3 Ru6 Cu2 56.58(17) . . ?
Cu3A Ru6 Cu2 60.7(3) . . ?
C16 Ru6 Te1 89.5(6) . . ?
C15 Ru6 Te1 175.6(6) . . ?
C17 Ru6 Te1 98.3(7) . . ?
Cu3 Ru6 Te1 91.28(15) . . ?
Cu3A Ru6 Te1 104.4(3) . . ?
Cu2 Ru6 Te1 109.26(8) . . ?
C16 Ru6 Ru9 119.4(6) . . ?
C15 Ru6 Ru9 122.6(6) . . ?
C17 Ru6 Ru9 51.0(7) . . ?
Cu3 Ru6 Ru9 147.03(15) . . ?
Cu3A Ru6 Ru9 162.4(3) . . ?
Cu2 Ru6 Ru9 116.16(9) . . ?
Te1 Ru6 Ru9 59.23(6) . . ?
C16 Ru6 Ru10 174.8(6) . . ?
C15 Ru6 Ru10 91.9(6) . . ?
C17 Ru6 Ru10 91.5(7) . . ?
Cu3 Ru6 Ru10 107.72(17) . . ?
Cu3A Ru6 Ru10 116.6(3) . . ?
Cu2 Ru6 Ru10 57.03(7) . . ?
Te1 Ru6 Ru10 85.72(6) . . ?
Ru9 Ru6 Ru10 59.49(6) . . ?
C16 Ru6 Ru7 117.0(6) . . ?
C15 Ru6 Ru7 120.9(6) . . ?
C17 Ru6 Ru7 138.0(7) . . ?
Cu3 Ru6 Ru7 62.08(15) . . ?
Cu3A Ru6 Ru7 77.3(3) . . ?
Cu2 Ru6 Ru7 54.55(7) . . ?
Te1 Ru6 Ru7 54.72(5) . . ?
Ru9 Ru6 Ru7 87.18(6) . . ?
Ru10 Ru6 Ru7 58.41(5) . . ?
C25 Ru7 C24 89.0(9) . . ?
C25 Ru7 C23 96.0(8) . . ?
C24 Ru7 C23 87.8(9) . . ?
C25 Ru7 Cu2 125.3(6) . . ?
C24 Ru7 Cu2 63.9(6) . . ?
C23 Ru7 Cu2 126.7(6) . . ?
C25 Ru7 Te1 88.8(6) . . ?
C24 Ru7 Te1 170.2(6) . . ?
C23 Ru7 Te1 102.0(6) . . ?
Cu2 Ru7 Te1 110.07(8) . . ?
C25 Ru7 Ru8 117.6(6) . . ?
C24 Ru7 Ru8 129.2(6) . . ?
C23 Ru7 Ru8 49.6(7) . . ?
Cu2 Ru7 Ru8 116.23(8) . . ?
Te1 Ru7 Ru8 59.95(6) . . ?
C25 Ru7 Ru10 174.2(6) . . ?
C24 Ru7 Ru10 96.6(6) . . ?
C23 Ru7 Ru10 85.6(6) . . ?
Cu2 Ru7 Ru10 56.89(7) . . ?
Te1 Ru7 Ru10 85.48(6) . . ?
Ru8 Ru7 Ru10 59.50(6) . . ?
C25 Ru7 Cu3 81.1(6) . . ?
C24 Ru7 Cu3 86.3(6) . . ?
C23 Ru7 Cu3 173.5(7) . . ?
Cu2 Ru7 Cu3 52.43(15) . . ?
Te1 Ru7 Cu3 83.85(15) . . ?
Ru8 Ru7 Cu3 136.88(15) . . ?
Ru10 Ru7 Cu3 97.87(15) . . ?
C25 Ru7 Ru6 118.3(6) . . ?
C24 Ru7 Ru6 118.2(6) . . ?
C23 Ru7 Ru6 135.4(7) . . ?
Cu2 Ru7 Ru6 55.03(7) . . ?
Te1 Ru7 Ru6 55.06(5) . . ?
Ru8 Ru7 Ru6 87.72(6) . . ?
Ru10 Ru7 Ru6 57.70(5) . . ?
Cu3 Ru7 Ru6 50.54(14) . . ?
C22 Ru8 C21 93.6(11) . . ?
C22 Ru8 C20 85.4(9) . . ?
C21 Ru8 C20 94.0(9) . . ?
C22 Ru8 C23 81.7(9) . . ?
C21 Ru8 C23 96.0(9) . . ?
C20 Ru8 C23 164.1(8) . . ?
C22 Ru8 Te1 177.3(7) . . ?
C21 Ru8 Te1 86.2(8) . . ?
C20 Ru8 Te1 97.4(6) . . ?
C23 Ru8 Te1 95.6(6) . . ?
C22 Ru8 Ru9 123.7(7) . . ?
C21 Ru8 Ru9 115.1(7) . . ?
C20 Ru8 Ru9 47.6(6) . . ?
C23 Ru8 Ru9 136.0(6) . . ?
Te1 Ru8 Ru9 58.72(6) . . ?
C22 Ru8 Ru7 120.6(7) . . ?
C21 Ru8 Ru7 112.9(8) . . ?
C20 Ru8 Ru7 139.5(6) . . ?
C23 Ru8 Ru7 45.1(6) . . ?
Te1 Ru8 Ru7 57.14(6) . . ?
Ru9 Ru8 Ru7 92.57(7) . . ?
C22 Ru8 Ru10 94.9(7) . . ?
C21 Ru8 Ru10 171.5(8) . . ?
C20 Ru8 Ru10 87.4(6) . . ?
C23 Ru8 Ru10 84.6(6) . . ?
Te1 Ru8 Ru10 85.28(6) . . ?
Ru9 Ru8 Ru10 60.22(6) . . ?
Ru7 Ru8 Ru10 61.81(6) . . ?
C19 Ru9 C18 94.9(10) . . ?
C19 Ru9 C20 86.5(9) . . ?
C18 Ru9 C20 88.9(9) . . ?
C19 Ru9 C17 82.4(9) . . ?
C18 Ru9 C17 94.7(9) . . ?
C20 Ru9 C17 168.6(9) . . ?
C19 Ru9 Te1 172.8(6) . . ?
C18 Ru9 Te1 90.8(7) . . ?
C20 Ru9 Te1 98.0(6) . . ?
C17 Ru9 Te1 92.8(7) . . ?
C19 Ru9 Ru8 121.6(7) . . ?
C18 Ru9 Ru8 114.4(7) . . ?
C20 Ru9 Ru8 47.7(6) . . ?
C17 Ru9 Ru8 138.2(7) . . ?
Te1 Ru9 Ru8 59.28(6) . . ?
C19 Ru9 Ru6 115.7(6) . . ?
C18 Ru9 Ru6 120.0(7) . . ?
C20 Ru9 Ru6 139.5(6) . . ?
C17 Ru9 Ru6 45.9(7) . . ?
Te1 Ru9 Ru6 57.38(5) . . ?
Ru8 Ru9 Ru6 92.52(7) . . ?
C19 Ru9 Ru10 88.9(7) . . ?
C18 Ru9 Ru10 174.7(7) . . ?
C20 Ru9 Ru10 87.6(6) . . ?
C17 Ru9 Ru10 89.4(6) . . ?
Te1 Ru9 Ru10 85.67(6) . . ?
Ru8 Ru9 Ru10 60.38(6) . . ?
Ru6 Ru9 Ru10 61.15(6) . . ?
C28 Ru10 C27 93.9(10) . . ?
C28 Ru10 C26 92.5(10) . . ?
C27 Ru10 C26 93.3(9) . . ?
C28 Ru10 Cu2 69.8(7) . . ?
C27 Ru10 Cu2 81.0(8) . . ?
C26 Ru10 Cu2 160.9(6) . . ?
C28 Ru10 Ru9 168.5(8) . . ?
C27 Ru10 Ru9 96.7(7) . . ?
C26 Ru10 Ru9 82.4(7) . . ?
Cu2 Ru10 Ru9 116.32(9) . . ?
C28 Ru10 Ru8 109.4(8) . . ?
C27 Ru10 Ru8 154.8(8) . . ?
C26 Ru10 Ru8 76.9(6) . . ?
Cu2 Ru10 Ru8 115.20(8) . . ?
Ru9 Ru10 Ru8 59.40(6) . . ?
C28 Ru10 Ru6 127.0(7) . . ?
C27 Ru10 Ru6 81.9(7) . . ?
C26 Ru10 Ru6 140.3(7) . . ?
Cu2 Ru10 Ru6 57.32(7) . . ?
Ru9 Ru10 Ru6 59.36(6) . . ?
Ru8 Ru10 Ru6 90.87(6) . . ?
C28 Ru10 Ru7 85.4(7) . . ?
C27 Ru10 Ru7 135.1(7) . . ?
C26 Ru10 Ru7 131.6(6) . . ?
Cu2 Ru10 Ru7 56.67(7) . . ?
Ru9 Ru10 Ru7 90.23(7) . . ?
Ru8 Ru10 Ru7 58.69(6) . . ?
Ru6 Ru10 Ru7 63.89(6) . . ?
Cl1 Cu1 Cu3A 106.7(4) . . ?
Cl1 Cu1 Cu3 101.1(2) . . ?
Cu3A Cu1 Cu3 15.8(2) . . ?
Cl1 Cu1 Ru3 130.72(19) . . ?
Cu3A Cu1 Ru3 70.9(3) . . ?
Cu3 Cu1 Ru3 85.85(17) . . ?
Cl1 Cu1 Ru5 135.97(18) . . ?
Cu3A Cu1 Ru5 117.2(4) . . ?
Cu3 Cu1 Ru5 122.16(19) . . ?
Ru3 Cu1 Ru5 65.72(8) . . ?
Cl1 Cu1 Ru4 152.49(18) . . ?
Cu3A Cu1 Ru4 59.0(4) . . ?
Cu3 Cu1 Ru4 58.39(17) . . ?
Ru3 Cu1 Ru4 70.10(8) . . ?
Ru5 Cu1 Ru4 64.67(8) . . ?
Cl1 Cu1 Cu2 48.46(15) . . ?
Cu3A Cu1 Cu2 59.0(4) . . ?
Cu3 Cu1 Cu2 52.87(17) . . ?
Ru3 Cu1 Cu2 114.94(11) . . ?
Ru5 Cu1 Cu2 174.19(12) . . ?
Ru4 Cu1 Cu2 109.84(10) . . ?
Cl1 Cu2 Cu3 105.3(2) . . ?
Cl1 Cu2 C24 89.5(6) . . ?
Cu3 Cu2 C24 86.6(5) . . ?
Cl1 Cu2 Ru7 132.94(19) . . ?
Cu3 Cu2 Ru7 69.68(16) . . ?
C24 Cu2 Ru7 44.4(6) . . ?
Cl1 Cu2 Ru10 136.65(18) . . ?
Cu3 Cu2 Ru10 118.00(19) . . ?
C24 Cu2 Ru10 91.0(5) . . ?
Ru7 Cu2 Ru10 66.43(8) . . ?
Cl1 Cu2 Ru6 149.21(19) . . ?
Cu3 Cu2 Ru6 59.63(18) . . ?
C24 Cu2 Ru6 114.2(6) . . ?
Ru7 Cu2 Ru6 70.42(8) . . ?
Ru10 Cu2 Ru6 65.64(8) . . ?
Cl1 Cu2 Cu3A 99.3(4) . . ?
Cu3 Cu2 Cu3A 15.2(2) . . ?
C24 Cu2 Cu3A 100.6(5) . . ?
Ru7 Cu2 Cu3A 84.1(3) . . ?
Ru10 Cu2 Cu3A 123.1(3) . . ?
Ru6 Cu2 Cu3A 58.8(3) . . ?
Cl1 Cu2 Cu1 48.97(15) . . ?
Cu3 Cu2 Cu1 56.57(17) . . ?
C24 Cu2 Cu1 91.1(5) . . ?
Ru7 Cu2 Cu1 111.63(10) . . ?
Ru10 Cu2 Cu1 174.04(12) . . ?
Ru6 Cu2 Cu1 108.42(10) . . ?
Cu3A Cu2 Cu1 51.0(3) . . ?
Cu3A Cu3 C10 97.2(18) . . ?
Cu3A Cu3 Cu2 98.0(17) . . ?
C10 Cu3 Cu2 162.2(6) . . ?
Cu3A Cu3 Ru6 86.7(18) . . ?
C10 Cu3 Ru6 126.4(6) . . ?
Cu2 Cu3 Ru6 63.79(18) . . ?
Cu3A Cu3 Ru4 78.0(17) . . ?
C10 Cu3 Ru4 44.6(6) . . ?
Cu2 Cu3 Ru4 131.0(3) . . ?
Ru6 Cu3 Ru4 159.8(3) . . ?
Cu3A Cu3 Cu1 68.1(17) . . ?
C10 Cu3 Cu1 107.1(6) . . ?
Cu2 Cu3 Cu1 70.6(2) . . ?
Ru6 Cu3 Cu1 123.5(3) . . ?
Ru4 Cu3 Cu1 62.61(17) . . ?
Cu3A Cu3 Ru7 150.1(18) . . ?
C10 Cu3 Ru7 109.9(6) . . ?
Cu2 Cu3 Ru7 57.89(15) . . ?
Ru6 Cu3 Ru7 67.38(17) . . ?
Ru4 Cu3 Ru7 130.5(3) . . ?
Cu1 Cu3 Ru7 113.3(3) . . ?
Cu3 Cu3A Cu1 96.1(18) . . ?
Cu3 Cu3A C16 98.2(19) . . ?
Cu1 Cu3A C16 160.9(8) . . ?
Cu3 Cu3A Ru4 86.1(17) . . ?
Cu1 Cu3A Ru4 65.7(4) . . ?
C16 Cu3A Ru4 127.8(8) . . ?
Cu3 Cu3A Ru6 77.6(17) . . ?
Cu1 Cu3A Ru6 128.6(6) . . ?
C16 Cu3A Ru6 44.0(6) . . ?
Ru4 Cu3A Ru6 159.0(6) . . ?
Cu3 Cu3A Cu2 66.7(16) . . ?
Cu1 Cu3A Cu2 70.1(4) . . ?
C16 Cu3A Cu2 104.2(8) . . ?
Ru4 Cu3A Cu2 124.5(6) . . ?
Ru6 Cu3A Cu2 60.5(3) . . ?
Cu3 Cu3A Ru3 149(2) . . ?
Cu1 Cu3A Ru3 58.1(3) . . ?
C16 Cu3A Ru3 111.4(6) . . ?
Ru4 Cu3A Ru3 67.6(4) . . ?
Ru6 Cu3A Ru3 131.7(5) . . ?
Cu2 Cu3A Ru3 113.7(5) . . ?
Cu2 Cl1 Cu1 82.6(2) . . ?
C41 P1 C47 109.7(10) . . ?
C41 P1 C35 108.9(10) . . ?
C47 P1 C35 107.5(10) . . ?
C41 P1 C29 110.5(10) . . ?
C47 P1 C29 110.5(10) . . ?
C35 P1 C29 109.7(10) . . ?
C53 P2 C65 107.0(10) . . ?
C53 P2 C59 109.5(9) . . ?
C65 P2 C59 110.9(10) . . ?
C53 P2 C71 111.3(11) . . ?
C65 P2 C71 110.5(11) . . ?
C59 P2 C71 107.6(10) . . ?

_diffrn_measured_fraction_theta_max 0.987
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.987
_refine_diff_density_max         1.203
_refine_diff_density_min         -2.100
_refine_diff_density_rms         0.378
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_2

_database_code_depnum_ccdc_archive 'CCDC 1029049'
_audit_update_record             
;
2015-02-17 deposited with the CCDC.
2015-02-26 downloaded from the CCDC.
;

_audit_creation_date             2015-02-09
_audit_creation_method           
; ?
;
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'C38 Cu2 O38 Ru14 Te4 4-,4(C24 H20 P 1+),3(C4 H10 O)'
_chemical_formula_sum            'C146 H110 Cu2 O41 P4 Ru14 Te4'
_chemical_formula_weight         4696.67
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0030 0.0020 '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'
Cu Cu 0.3200 1.2650 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0110 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1020 0.0940 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2590 0.8360 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Te Te -0.5310 1.6750 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   14.1879(18)
_cell_length_b                   14.2101(18)
_cell_length_c                   22.732(3)
_cell_angle_alpha                76.598(9)
_cell_angle_beta                 75.207(9)
_cell_angle_gamma                60.659(8)
_cell_volume                     3831.6(9)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    ?
_cell_measurement_temperature    200(2)
_cell_measurement_theta_max      ?
_cell_measurement_theta_min      ?
_shelx_estimated_absorpt_T_max   0.886
_shelx_estimated_absorpt_T_min   0.292
_exptl_absorpt_coefficient_mu    2.471
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.2926
_exptl_absorpt_correction_T_max  0.8865
_exptl_absorpt_process_details   'SADABS, 2003'
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    2.035
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             2256
_exptl_crystal_size_max          0.66
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.05
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.1119
_diffrn_reflns_av_unetI/netI     0.2123
_diffrn_reflns_Laue_measured_fraction_full 0.974
_diffrn_reflns_Laue_measured_fraction_max 0.966
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            33070
_diffrn_reflns_point_group_measured_fraction_full 0.974
_diffrn_reflns_point_group_measured_fraction_max 0.966
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.317
_diffrn_reflns_theta_min         2.706
_diffrn_ambient_temperature      200(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.974
_diffrn_measured_fraction_theta_max 0.966
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       'CCD rotation images, thick slices'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                6386
_reflns_number_total             13506
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL 2014/7 (Sheldrick, 2008)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_refine_diff_density_max         1.387
_refine_diff_density_min         -1.809
_refine_diff_density_rms         0.234
_refine_ls_extinction_coef       0.00128(15)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014)'
_refine_ls_goodness_of_fit_ref   0.966
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     949
_refine_ls_number_reflns         13506
_refine_ls_number_restraints     1002
_refine_ls_R_factor_all          0.1851
_refine_ls_R_factor_gt           0.0805
_refine_ls_restrained_S_all      0.937
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0830P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1636
_refine_ls_wR_factor_ref         0.2098
_refine_special_details          
; An Et₂O molecule is chaotically disordered around an inversion centre 
(0 1/2 1/2). It was approximated by arbitrary atomic positions O(21), C(72),
C(73), C(74), C(75) with partial occupancies. 
;

_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Te1 Te 0.76158(8) 0.09373(8) 0.29047(5) 0.0381(3) Uani 1 1 d . U . . .
Te2 Te 1.10166(8) -0.12994(8) 0.47274(5) 0.0391(3) Uani 1 1 d . U . . .
Ru1 Ru 0.63534(10) 0.27985(10) 0.22340(6) 0.0338(4) Uani 1 1 d . U . . .
Ru2 Ru 0.75526(10) 0.08249(10) 0.17349(6) 0.0345(4) Uani 1 1 d . U . . .
Ru3 Ru 0.94905(10) 0.04504(10) 0.21049(7) 0.0441(4) Uani 1 1 d . U . . .
Ru4 Ru 0.82816(10) 0.24798(10) 0.26058(6) 0.0345(4) Uani 1 1 d . U . . .
Ru5 Ru 0.83314(10) 0.24441(10) 0.13644(6) 0.0336(4) Uani 1 1 d . U . . .
Ru6 Ru 0.88516(10) -0.00232(10) 0.46257(6) 0.0372(4) Uani 1 1 d . U . . .
Ru7 Ru 1.04987(10) 0.08090(10) 0.42171(6) 0.0364(4) Uani 1 1 d . U . . .
Cu1 Cu 0.91658(17) 0.10140(18) 0.34975(10) 0.0555(6) Uani 1 1 d . U . . .
O1 O 0.4669(10) 0.3184(11) 0.3398(6) 0.089(5) Uani 1 1 d . U . . .
O2 O 0.4799(10) 0.5028(10) 0.1701(6) 0.074(4) Uani 1 1 d . U . . .
O3 O 0.5100(9) 0.2145(9) 0.1677(6) 0.069(4) Uani 1 1 d . U . . .
O4 O 0.7416(9) 0.0817(9) 0.0437(5) 0.058(3) Uani 1 1 d . U . . .
O5 O 0.6858(9) -0.0946(9) 0.2177(5) 0.054(3) Uani 1 1 d . U . . .
O6 O 0.9831(8) -0.1237(9) 0.1369(6) 0.060(3) Uani 1 1 d . U . . .
O7 O 1.1002(10) -0.1513(10) 0.2876(6) 0.079(4) Uani 1 1 d . U . . .
O8 O 1.1450(9) 0.0651(9) 0.1286(6) 0.077(4) Uani 1 1 d . U . . .
O9 O 1.0468(9) 0.2501(9) 0.2377(5) 0.060(3) Uani 1 1 d . U . . .
O10 O 0.7289(9) 0.3523(10) 0.3787(5) 0.060(3) Uani 1 1 d . U . . .
O11 O 0.7228(8) 0.4744(8) 0.1962(5) 0.049(3) Uani 1 1 d . U . . .
O12 O 0.9881(10) 0.3489(10) 0.0966(5) 0.067(4) Uani 1 1 d . U . . .
O13 O 0.6629(10) 0.4160(10) 0.0588(5) 0.074(4) Uani 1 1 d . U . . .
O14 O 0.9584(11) 0.1113(10) 0.0293(6) 0.082(5) Uani 1 1 d . U . . .
O15 O 0.9681(9) 0.3180(9) 0.3747(5) 0.055(3) Uani 1 1 d . U . . .
O16 O 1.1950(11) 0.0128(10) 0.3031(6) 0.077(4) Uani 1 1 d . U . . .
O17 O 0.6566(9) 0.1669(9) 0.4463(6) 0.063(4) Uani 1 1 d . U . . .
O18 O 0.8969(10) -0.1564(10) 0.3873(6) 0.068(4) Uani 1 1 d . U . . .
O19 O 0.7600(10) -0.1044(11) 0.5600(5) 0.076(4) Uani 1 1 d . U . . .
C1 C 0.5281(13) 0.3079(13) 0.2969(8) 0.047(4) Uani 1 1 d . U . . .
C2 C 0.5419(13) 0.4152(14) 0.1892(8) 0.049(4) Uani 1 1 d . U . . .
C3 C 0.5883(12) 0.2052(12) 0.1814(7) 0.039(3) Uani 1 1 d . U . . .
C4 C 0.7500(12) 0.0825(13) 0.0922(8) 0.046(4) Uani 1 1 d . U . . .
C5 C 0.7140(12) -0.0282(12) 0.2033(7) 0.038(4) Uani 1 1 d . U . . .
C6 C 0.9387(12) -0.0442(13) 0.1612(8) 0.044(3) Uani 1 1 d . U . . .
C7 C 1.0376(13) -0.0739(13) 0.2611(8) 0.048(4) Uani 1 1 d . U . . .
C8 C 1.0701(14) 0.0612(14) 0.1620(9) 0.058(4) Uani 1 1 d . U . . .
C9 C 0.9638(13) 0.2464(12) 0.2478(7) 0.043(4) Uani 1 1 d . U . . .
C10 C 0.7702(13) 0.3059(13) 0.3344(8) 0.040(3) Uani 1 1 d . U . . .
C11 C 0.7538(12) 0.3819(13) 0.2103(7) 0.040(3) Uani 1 1 d . U . . .
C12 C 0.9314(13) 0.3119(12) 0.1144(7) 0.039(4) Uani 1 1 d . U . . .
C13 C 0.7233(13) 0.3504(13) 0.0896(7) 0.043(4) Uani 1 1 d . U . . .
C14 C 0.9077(13) 0.1560(13) 0.0713(8) 0.048(4) Uani 1 1 d . U . . .
C15 C 0.9986(12) 0.2286(13) 0.3905(7) 0.040(4) Uani 1 1 d . U . . .
C16 C 1.1381(13) 0.0384(13) 0.3463(8) 0.042(4) Uani 1 1 d . U . . .
C17 C 0.7437(14) 0.1051(13) 0.4496(8) 0.044(4) Uani 1 1 d . U . . .
C18 C 0.8919(13) -0.0949(13) 0.4145(8) 0.045(4) Uani 1 1 d . U . . .
C19 C 0.8283(13) -0.0722(14) 0.5427(7) 0.052(4) Uani 1 1 d . U . . .
P2 P 0.6327(3) -0.2904(3) 0.3676(2) 0.0406(11) Uani 1 1 d . U . . .
C44 C 0.6349(14) -0.3784(13) 0.4381(8) 0.044(4) Uani 1 1 d . U . . .
C45 C 0.7256(17) -0.4745(15) 0.4490(9) 0.080(6) Uani 1 1 d . U . . .
H45 H 0.7899 -0.4968 0.4187 0.096 Uiso 1 1 calc R . . . .
C46 C 0.722(2) -0.5383(17) 0.5041(10) 0.100(7) Uani 1 1 d . U . . .
H46 H 0.7866 -0.6024 0.5137 0.120 Uiso 1 1 calc R . . . .
C47 C 0.6267(19) -0.5095(18) 0.5453(10) 0.086(6) Uani 1 1 d . U . . .
H47 H 0.6223 -0.5596 0.5804 0.103 Uiso 1 1 calc R . . . .
C48 C 0.542(2) -0.4159(19) 0.5378(10) 0.098(7) Uani 1 1 d . U . . .
H48 H 0.4786 -0.3938 0.5685 0.118 Uiso 1 1 calc R . . . .
C49 C 0.5477(18) -0.3479(19) 0.4825(10) 0.103(8) Uani 1 1 d . U . . .
H49 H 0.4873 -0.2779 0.4766 0.123 Uiso 1 1 calc R . . . .
C50 C 0.5863(12) -0.1564(12) 0.3849(8) 0.041(3) Uani 1 1 d . U . . .
C51 C 0.6267(12) -0.1444(13) 0.4295(7) 0.044(4) Uani 1 1 d . U . . .
H51 H 0.6739 -0.2071 0.4529 0.052 Uiso 1 1 calc R . . . .
C52 C 0.5995(13) -0.0407(13) 0.4414(8) 0.049(4) Uani 1 1 d . U . . .
H52 H 0.6258 -0.0322 0.4733 0.059 Uiso 1 1 calc R . . . .
C53 C 0.5337(13) 0.0483(14) 0.4056(8) 0.052(4) Uani 1 1 d . U . . .
H53 H 0.5147 0.1191 0.4131 0.062 Uiso 1 1 calc R . . . .
C54 C 0.4953(14) 0.0382(14) 0.3601(8) 0.056(4) Uani 1 1 d . U . . .
H54 H 0.4509 0.1008 0.3354 0.068 Uiso 1 1 calc R . . . .
C55 C 0.5225(12) -0.0684(13) 0.3497(8) 0.049(4) Uani 1 1 d . U . . .
H55 H 0.4958 -0.0773 0.3181 0.059 Uiso 1 1 calc R . . . .
C56 C 0.5367(12) -0.2834(12) 0.3260(7) 0.039(3) Uani 1 1 d . U . . .
C57 C 0.4283(14) -0.2477(16) 0.3531(9) 0.068(5) Uani 1 1 d . U . . .
H57 H 0.4055 -0.2265 0.3930 0.081 Uiso 1 1 calc R . . . .
C58 C 0.3533(14) -0.2424(15) 0.3235(9) 0.066(5) Uani 1 1 d . U . . .
H58 H 0.2786 -0.2179 0.3423 0.079 Uiso 1 1 calc R . . . .
C59 C 0.3894(14) -0.2741(14) 0.2644(8) 0.063(5) Uani 1 1 d . U . . .
H59 H 0.3386 -0.2737 0.2440 0.076 Uiso 1 1 calc R . . . .
C60 C 0.4945(14) -0.3051(15) 0.2358(9) 0.066(5) Uani 1 1 d . U . . .
H60 H 0.5176 -0.3223 0.1949 0.079 Uiso 1 1 calc R . . . .
C61 C 0.5649(14) -0.3104(15) 0.2685(8) 0.066(5) Uani 1 1 d . U . . .
H61 H 0.6396 -0.3348 0.2496 0.080 Uiso 1 1 calc R . . . .
C62 C 0.7650(12) -0.3368(12) 0.3232(7) 0.039(3) Uani 1 1 d . U . . .
C63 C 0.8164(13) -0.4377(13) 0.3010(8) 0.053(4) Uani 1 1 d . U . . .
H63 H 0.7800 -0.4817 0.3100 0.064 Uiso 1 1 calc R . . . .
C64 C 0.9245(13) -0.4748(13) 0.2645(7) 0.050(4) Uani 1 1 d . U . . .
H64 H 0.9587 -0.5400 0.2462 0.060 Uiso 1 1 calc R . . . .
C65 C 0.9765(14) -0.4102(13) 0.2572(8) 0.056(5) Uani 1 1 d . U . . .
H65 H 1.0498 -0.4358 0.2358 0.067 Uiso 1 1 calc R . . . .
C66 C 0.9292(13) -0.3147(15) 0.2786(8) 0.064(5) Uani 1 1 d . U . . .
H66 H 0.9673 -0.2725 0.2707 0.076 Uiso 1 1 calc R . . . .
C67 C 0.8219(13) -0.2763(13) 0.3130(8) 0.051(5) Uani 1 1 d . U . . .
H67 H 0.7887 -0.2090 0.3291 0.062 Uiso 1 1 calc R . . . .
P1 P 0.3560(3) 0.2749(3) 0.01827(18) 0.0300(10) Uani 1 1 d . U . . .
C20 C 0.2716(11) 0.3986(11) 0.0510(7) 0.033(3) Uani 1 1 d . U . . .
C21 C 0.2999(12) 0.4122(12) 0.1008(7) 0.042(4) Uani 1 1 d . U . . .
H21 H 0.3611 0.3556 0.1183 0.050 Uiso 1 1 calc R . . . .
C22 C 0.2359(13) 0.5126(13) 0.1257(8) 0.054(4) Uani 1 1 d . U . . .
H22 H 0.2555 0.5237 0.1595 0.065 Uiso 1 1 calc R . . . .
C23 C 0.1451(13) 0.5943(14) 0.1010(8) 0.052(4) Uani 1 1 d . U . . .
H23 H 0.1027 0.6616 0.1174 0.063 Uiso 1 1 calc R . . . .
C24 C 0.1176(13) 0.5760(13) 0.0523(8) 0.057(5) Uani 1 1 d . U . . .
H24 H 0.0543 0.6310 0.0360 0.068 Uiso 1 1 calc R . . . .
C25 C 0.1797(12) 0.4799(12) 0.0263(8) 0.046(4) Uani 1 1 d . U . . .
H25 H 0.1600 0.4696 -0.0077 0.055 Uiso 1 1 calc R . . . .
C26 C 0.2846(11) 0.2597(11) -0.0302(7) 0.031(3) Uani 1 1 d . U . . .
C27 C 0.2363(11) 0.1917(12) -0.0118(7) 0.037(4) Uani 1 1 d . U . . .
H27 H 0.2443 0.1480 0.0269 0.044 Uiso 1 1 calc R . . . .
C28 C 0.1760(12) 0.1865(13) -0.0495(8) 0.046(4) Uani 1 1 d . U . . .
H28 H 0.1429 0.1393 -0.0362 0.055 Uiso 1 1 calc R . . . .
C29 C 0.1641(12) 0.2483(13) -0.1051(8) 0.047(4) Uani 1 1 d . U . . .
H29 H 0.1234 0.2439 -0.1307 0.056 Uiso 1 1 calc R . . . .
C30 C 0.2118(12) 0.3184(13) -0.1243(8) 0.049(4) Uani 1 1 d . U . . .
H30 H 0.2035 0.3612 -0.1633 0.059 Uiso 1 1 calc R . . . .
C31 C 0.2702(11) 0.3263(12) -0.0880(7) 0.041(4) Uani 1 1 d . U . . .
H31 H 0.3009 0.3756 -0.1010 0.049 Uiso 1 1 calc R . . . .
C32 C 0.4825(11) 0.2717(11) -0.0259(6) 0.031(3) Uani 1 1 d . U . . .
C33 C 0.5410(12) 0.1975(12) -0.0691(7) 0.038(4) Uani 1 1 d . U . . .
H33 H 0.5112 0.1557 -0.0772 0.046 Uiso 1 1 calc R . . . .
C34 C 0.6412(12) 0.1865(13) -0.0992(7) 0.047(4) Uani 1 1 d . U . . .
H34 H 0.6822 0.1353 -0.1279 0.057 Uiso 1 1 calc R . . . .
C35 C 0.6830(13) 0.2466(13) -0.0892(7) 0.043(4) Uani 1 1 d . U . . .
H35 H 0.7534 0.2370 -0.1107 0.052 Uiso 1 1 calc R . . . .
C36 C 0.6271(12) 0.3210(13) -0.0490(7) 0.045(4) Uani 1 1 d . U . . .
H36 H 0.6562 0.3652 -0.0433 0.054 Uiso 1 1 calc R . . . .
C37 C 0.5268(12) 0.3309(12) -0.0165(7) 0.039(4) Uani 1 1 d . U . . .
H37 H 0.4882 0.3804 0.0131 0.047 Uiso 1 1 calc R . . . .
C38 C 0.3899(11) 0.1636(11) 0.0773(6) 0.027(3) Uani 1 1 d . U . . .
C39 C 0.4928(12) 0.0757(12) 0.0772(7) 0.039(4) Uani 1 1 d . U . . .
H39 H 0.5497 0.0740 0.0439 0.047 Uiso 1 1 calc R . . . .
C40 C 0.5151(13) -0.0075(13) 0.1228(7) 0.045(4) Uani 1 1 d . U . . .
H40 H 0.5862 -0.0678 0.1207 0.054 Uiso 1 1 calc R . . . .
C41 C 0.4364(14) -0.0055(14) 0.1715(8) 0.053(4) Uani 1 1 d . U . . .
H41 H 0.4539 -0.0643 0.2038 0.064 Uiso 1 1 calc R . . . .
C42 C 0.3317(14) 0.0794(13) 0.1757(8) 0.056(5) Uani 1 1 d . U . . .
H42 H 0.2767 0.0794 0.2099 0.067 Uiso 1 1 calc R . . . .
C43 C 0.3095(13) 0.1631(13) 0.1295(7) 0.044(4) Uani 1 1 d . U . . .
H43 H 0.2382 0.2232 0.1321 0.053 Uiso 1 1 calc R . . . .
O20 O 1.2348(12) 0.4321(13) 0.2928(9) 0.119(5) Uani 1 1 d . U . . .
C68 C 1.224(2) 0.587(2) 0.3087(14) 0.163(11) Uani 1 1 d . U . . .
H68A H 1.2066 0.6375 0.3373 0.245 Uiso 1 1 calc R . . . .
H68B H 1.3010 0.5605 0.2892 0.245 Uiso 1 1 calc R . . . .
H68C H 1.1769 0.6247 0.2772 0.245 Uiso 1 1 calc R . . . .
C69 C 1.206(2) 0.497(2) 0.3413(15) 0.147(10) Uani 1 1 d . U . . .
H69A H 1.1279 0.5212 0.3609 0.177 Uiso 1 1 calc R . . . .
H69B H 1.2531 0.4564 0.3730 0.177 Uiso 1 1 calc R . . . .
C70 C 1.228(2) 0.3308(19) 0.3216(13) 0.117(8) Uani 1 1 d . U . . .
H70A H 1.2770 0.2913 0.3524 0.141 Uiso 1 1 calc R . . . .
H70B H 1.1517 0.3476 0.3422 0.141 Uiso 1 1 calc R . . . .
C71 C 1.259(2) 0.2672(18) 0.2744(12) 0.120(9) Uani 1 1 d . U . . .
H71A H 1.2557 0.1989 0.2916 0.180 Uiso 1 1 calc R . . . .
H71B H 1.2099 0.3071 0.2442 0.180 Uiso 1 1 calc R . . . .
H71C H 1.3346 0.2511 0.2543 0.180 Uiso 1 1 calc R . . . .
O21 O 0.978(5) 0.475(6) 0.468(3) 0.187(19) Uiso 0.5 1 d . U P . .
C72 C 0.931(6) 0.582(7) 0.467(3) 0.15(2) Uiso 0.5 1 d . U P . .
C73 C 0.975(5) 0.613(5) 0.498(3) 0.144(19) Uiso 0.6 1 d . U P . .
C74 C 1.064(10) 0.490(11) 0.477(6) 0.22(5) Uiso 0.4 1 d . U P . .
C75 C 1.128(6) 0.356(6) 0.486(3) 0.17(3) Uiso 0.5 1 d . U P . .


_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
Te1 Ru1 2.7221(16) . ?
Te1 Ru2 2.7271(17) . ?
Te1 Ru3 2.6774(17) . ?
Te1 Ru4 2.6776(15) . ?
Te1 Cu1 2.912(2) . ?
Te2 Ru6 2.7361(17) . ?
Te2 Ru6 2.7378(17) 2_756 ?
Te2 Ru7 2.7455(16) 2_756 ?
Te2 Ru7 2.7438(16) . ?
Ru1 Ru2 2.8036(18) . ?
Ru1 Ru4 2.8623(17) . ?
Ru1 Ru5 2.8775(17) . ?
Ru1 C1 1.919(17) . ?
Ru1 C2 1.843(17) . ?
Ru1 C3 1.993(16) . ?
Ru2 Ru3 2.8441(18) . ?
Ru2 Ru5 2.8882(16) . ?
Ru2 C3 2.137(15) . ?
Ru2 C4 1.868(19) . ?
Ru2 C5 1.866(15) . ?
Ru2 C6 2.315(15) . ?
Ru3 Ru4 2.8693(19) . ?
Ru3 Ru5 2.8638(18) . ?
Ru3 C6 1.953(17) . ?
Ru3 C7 1.875(17) . ?
Ru3 C8 1.877(17) . ?
Ru4 Ru5 2.8166(18) . ?
Ru4 Cu1 2.608(2) . ?
Ru4 C9 1.861(16) . ?
Ru4 C10 1.856(18) . ?
Ru4 C11 1.918(16) . ?
Ru5 C11 2.511(15) . ?
Ru5 C12 1.961(15) . ?
Ru5 C13 1.906(17) . ?
Ru5 C14 1.910(18) . ?
Ru6 Te2 2.7378(17) 2_756 ?
Ru6 Ru7 2.8078(18) 2_756 ?
Ru6 Ru7 2.9686(17) . ?
Ru6 Cu1 2.694(2) . ?
Ru6 C17 1.881(17) . ?
Ru6 C18 1.851(18) . ?
Ru6 C19 2.037(16) . ?
Ru7 Te2 2.7454(16) 2_756 ?
Ru7 Ru6 2.8078(18) 2_756 ?
Ru7 Cu1 2.675(2) . ?
Ru7 C15 1.874(16) . ?
Ru7 C16 1.874(17) . ?
Ru7 C19 2.028(16) 2_756 ?
O1 C1 1.111(16) . ?
O2 C2 1.176(17) . ?
O3 C3 1.167(16) . ?
O4 C4 1.142(17) . ?
O5 C5 1.149(14) . ?
O6 C6 1.179(16) . ?
O7 C7 1.170(17) . ?
O8 C8 1.155(17) . ?
O9 C9 1.166(15) . ?
O10 C10 1.192(17) . ?
O11 C11 1.156(15) . ?
O12 C12 1.112(15) . ?
O13 C13 1.146(17) . ?
O14 C14 1.147(17) . ?
O15 C15 1.123(16) . ?
O16 C16 1.106(16) . ?
O17 C17 1.121(16) . ?
O18 C18 1.148(17) . ?
O19 C19 1.209(16) . ?
C19 Ru7 2.028(16) 2_756 ?
P2 C44 1.787(17) . ?
P2 C50 1.789(16) . ?
P2 C56 1.802(16) . ?
P2 C62 1.761(15) . ?
C44 C45 1.37(2) . ?
C44 C49 1.33(2) . ?
C45 C46 1.37(2) . ?
C46 C47 1.37(3) . ?
C47 C48 1.29(3) . ?
C48 C49 1.41(3) . ?
C50 C51 1.36(2) . ?
C50 C55 1.35(2) . ?
C51 C52 1.402(19) . ?
C52 C53 1.37(2) . ?
C53 C54 1.35(2) . ?
C54 C55 1.43(2) . ?
C56 C57 1.38(2) . ?
C56 C61 1.35(2) . ?
C57 C58 1.36(2) . ?
C58 C59 1.40(2) . ?
C59 C60 1.35(2) . ?
C60 C61 1.36(2) . ?
C62 C63 1.40(2) . ?
C62 C67 1.392(18) . ?
C63 C64 1.44(2) . ?
C64 C65 1.39(2) . ?
C65 C66 1.33(2) . ?
C66 C67 1.41(2) . ?
P1 C20 1.779(15) . ?
P1 C26 1.784(15) . ?
P1 C32 1.804(13) . ?
P1 C38 1.769(14) . ?
C20 C21 1.376(19) . ?
C20 C25 1.40(2) . ?
C21 C22 1.42(2) . ?
C22 C23 1.39(2) . ?
C23 C24 1.38(2) . ?
C24 C25 1.38(2) . ?
C26 C27 1.375(17) . ?
C26 C31 1.426(19) . ?
C27 C28 1.39(2) . ?
C28 C29 1.36(2) . ?
C29 C30 1.40(2) . ?
C30 C31 1.37(2) . ?
C32 C33 1.404(19) . ?
C32 C37 1.349(17) . ?
C33 C34 1.360(18) . ?
C34 C35 1.337(19) . ?
C35 C36 1.36(2) . ?
C36 C37 1.379(18) . ?
C38 C39 1.380(18) . ?
C38 C43 1.422(18) . ?
C39 C40 1.343(19) . ?
C40 C41 1.35(2) . ?
C41 C42 1.38(2) . ?
C42 C43 1.36(2) . ?
O20 C69 1.45(3) . ?
O20 C70 1.48(2) . ?
C68 C69 1.43(3) . ?
C70 C71 1.41(3) . ?
O21 C72 1.33(7) . ?
O21 C73 1.27(6) 2_766 ?
O21 C74 1.35(11) 2_766 ?
O21 C74 1.42(11) . ?
C72 C73 1.32(7) . ?
C72 C74 1.44(12) 2_766 ?
C72 C74 1.73(13) . ?
C72 C75 1.37(9) 2_766 ?
C73 O21 1.27(6) 2_766 ?
C73 C74 1.74(12) 2_766 ?
C73 C74 1.68(13) . ?
C73 C75 1.28(8) 2_766 ?
C74 O21 1.35(11) 2_766 ?
C74 C72 1.44(12) 2_766 ?
C74 C73 1.74(12) 2_766 ?
C74 C74 1.8(2) 2_766 ?
C74 C75 1.65(13) . ?
C75 C72 1.37(9) 2_766 ?
C75 C73 1.28(8) 2_766 ?

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
Ru1 Te1 Ru2 61.93(4) . . ?
Ru1 Te1 Cu1 117.30(6) . . ?
Ru2 Te1 Cu1 135.00(6) . . ?
Ru3 Te1 Ru1 96.63(5) . . ?
Ru3 Te1 Ru2 63.50(5) . . ?
Ru3 Te1 Ru4 64.80(4) . . ?
Ru3 Te1 Cu1 72.44(6) . . ?
Ru4 Te1 Ru1 64.02(4) . . ?
Ru4 Te1 Ru2 95.90(5) . . ?
Ru4 Te1 Cu1 55.43(5) . . ?
Ru6 Te2 Ru6 96.25(5) . 2_756 ?
Ru6 Te2 Ru7 65.60(4) . . ?
Ru6 Te2 Ru7 61.63(4) . 2_756 ?
Ru6 Te2 Ru7 61.62(4) 2_756 . ?
Ru6 Te2 Ru7 65.56(4) 2_756 2_756 ?
Ru7 Te2 Ru7 96.53(5) . 2_756 ?
Te1 Ru1 Ru2 59.12(4) . . ?
Te1 Ru1 Ru4 57.24(4) . . ?
Te1 Ru1 Ru5 86.43(5) . . ?
Ru2 Ru1 Ru4 90.19(5) . . ?
Ru2 Ru1 Ru5 61.10(4) . . ?
Ru4 Ru1 Ru5 58.77(4) . . ?
C1 Ru1 Te1 85.8(5) . . ?
C1 Ru1 Ru2 126.5(5) . . ?
C1 Ru1 Ru4 103.9(5) . . ?
C1 Ru1 Ru5 162.4(5) . . ?
C1 Ru1 C3 101.3(6) . . ?
C2 Ru1 Te1 171.1(5) . . ?
C2 Ru1 Ru2 129.6(5) . . ?
C2 Ru1 Ru4 120.2(5) . . ?
C2 Ru1 Ru5 99.3(5) . . ?
C2 Ru1 C1 86.8(7) . . ?
C2 Ru1 C3 92.1(7) . . ?
C3 Ru1 Te1 94.2(4) . . ?
C3 Ru1 Ru2 49.4(4) . . ?
C3 Ru1 Ru4 139.6(4) . . ?
C3 Ru1 Ru5 95.0(4) . . ?
Te1 Ru2 Ru1 58.95(4) . . ?
Te1 Ru2 Ru3 57.40(4) . . ?
Te1 Ru2 Ru5 86.13(5) . . ?
Ru1 Ru2 Ru3 91.12(5) . . ?
Ru1 Ru2 Ru5 60.72(4) . . ?
Ru3 Ru2 Ru5 59.94(4) . . ?
C3 Ru2 Te1 90.8(4) . . ?
C3 Ru2 Ru1 45.1(4) . . ?
C3 Ru2 Ru3 136.2(4) . . ?
C3 Ru2 Ru5 91.6(4) . . ?
C3 Ru2 C6 177.0(6) . . ?
C4 Ru2 Te1 176.9(5) . . ?
C4 Ru2 Ru1 118.4(5) . . ?
C4 Ru2 Ru3 122.1(5) . . ?
C4 Ru2 Ru5 91.1(5) . . ?
C4 Ru2 C3 87.9(6) . . ?
C4 Ru2 C6 90.8(6) . . ?
C5 Ru2 Te1 89.3(5) . . ?
C5 Ru2 Ru1 119.5(4) . . ?
C5 Ru2 Ru3 114.6(5) . . ?
C5 Ru2 Ru5 174.3(5) . . ?
C5 Ru2 C3 91.9(6) . . ?
C5 Ru2 C4 93.5(7) . . ?
C5 Ru2 C6 90.8(6) . . ?
C6 Ru2 Te1 90.3(4) . . ?
C6 Ru2 Ru1 133.8(4) . . ?
C6 Ru2 Ru3 43.0(4) . . ?
C6 Ru2 Ru5 85.8(4) . . ?
Te1 Ru3 Ru2 59.10(4) . . ?
Te1 Ru3 Ru4 57.60(4) . . ?
Te1 Ru3 Ru5 87.55(5) . . ?
Ru2 Ru3 Ru4 89.25(5) . . ?
Ru2 Ru3 Ru5 60.79(4) . . ?
Ru5 Ru3 Ru4 58.85(4) . . ?
C6 Ru3 Te1 100.4(4) . . ?
C6 Ru3 Ru2 53.9(4) . . ?
C6 Ru3 Ru4 142.7(4) . . ?
C6 Ru3 Ru5 93.6(5) . . ?
C7 Ru3 Te1 95.9(5) . . ?
C7 Ru3 Ru2 128.6(5) . . ?
C7 Ru3 Ru4 115.8(5) . . ?
C7 Ru3 Ru5 170.4(5) . . ?
C7 Ru3 C6 94.6(7) . . ?
C7 Ru3 C8 92.2(7) . . ?
C8 Ru3 Te1 158.2(5) . . ?
C8 Ru3 Ru2 128.3(6) . . ?
C8 Ru3 Ru4 100.7(5) . . ?
C8 Ru3 Ru5 81.5(5) . . ?
C8 Ru3 C6 99.1(7) . . ?
Te1 Ru4 Ru1 58.75(4) . . ?
Te1 Ru4 Ru3 57.60(4) . . ?
Te1 Ru4 Ru5 88.53(5) . . ?
Ru1 Ru4 Ru3 89.43(5) . . ?
Ru5 Ru4 Ru1 60.88(4) . . ?
Ru5 Ru4 Ru3 60.48(5) . . ?
Cu1 Ru4 Te1 66.85(6) . . ?
Cu1 Ru4 Ru1 123.16(6) . . ?
Cu1 Ru4 Ru3 74.14(7) . . ?
Cu1 Ru4 Ru5 134.60(8) . . ?
C9 Ru4 Te1 134.2(5) . . ?
C9 Ru4 Ru1 154.5(5) . . ?
C9 Ru4 Ru3 84.9(5) . . ?
C9 Ru4 Ru5 95.1(5) . . ?
C9 Ru4 Cu1 79.0(5) . . ?
C9 Ru4 C11 98.7(6) . . ?
C10 Ru4 Te1 97.6(4) . . ?
C10 Ru4 Ru1 101.5(5) . . ?
C10 Ru4 Ru3 142.2(5) . . ?
C10 Ru4 Ru5 154.7(5) . . ?
C10 Ru4 Cu1 69.6(5) . . ?
C10 Ru4 C9 98.0(7) . . ?
C10 Ru4 C11 95.9(6) . . ?
C11 Ru4 Te1 122.0(4) . . ?
C11 Ru4 Ru1 63.4(4) . . ?
C11 Ru4 Ru3 121.0(5) . . ?
C11 Ru4 Ru5 60.6(5) . . ?
C11 Ru4 Cu1 164.6(5) . . ?
Ru1 Ru5 Ru2 58.19(4) . . ?
Ru3 Ru5 Ru1 89.24(5) . . ?
Ru3 Ru5 Ru2 59.27(4) . . ?
Ru4 Ru5 Ru1 60.34(4) . . ?
Ru4 Ru5 Ru2 89.41(5) . . ?
Ru4 Ru5 Ru3 60.67(5) . . ?
C11 Ru5 Ru1 58.1(3) . . ?
C11 Ru5 Ru2 113.2(3) . . ?
C11 Ru5 Ru3 102.4(4) . . ?
C11 Ru5 Ru4 41.7(4) . . ?
C12 Ru5 Ru1 134.4(4) . . ?
C12 Ru5 Ru2 161.3(5) . . ?
C12 Ru5 Ru3 103.8(5) . . ?
C12 Ru5 Ru4 88.2(5) . . ?
C12 Ru5 C11 76.4(6) . . ?
C13 Ru5 Ru1 78.3(5) . . ?
C13 Ru5 Ru2 99.1(4) . . ?
C13 Ru5 Ru3 158.4(4) . . ?
C13 Ru5 Ru4 124.5(5) . . ?
C13 Ru5 C11 86.1(6) . . ?
C13 Ru5 C12 97.5(6) . . ?
C13 Ru5 C14 92.1(7) . . ?
C14 Ru5 Ru1 132.2(4) . . ?
C14 Ru5 Ru2 78.0(5) . . ?
C14 Ru5 Ru3 83.3(5) . . ?
C14 Ru5 Ru4 143.0(5) . . ?
C14 Ru5 C11 168.8(6) . . ?
C14 Ru5 C12 93.0(6) . . ?
Te2 Ru6 Te2 83.75(5) . 2_756 ?
Te2 Ru6 Ru7 57.35(4) 2_756 . ?
Te2 Ru6 Ru7 57.33(4) . . ?
Te2 Ru6 Ru7 59.30(4) 2_756 2_756 ?
Te2 Ru6 Ru7 59.35(4) . 2_756 ?
Ru7 Ru6 Ru7 90.29(5) 2_756 . ?
Cu1 Ru6 Te2 97.03(6) . . ?
Cu1 Ru6 Te2 97.34(6) . 2_756 ?
Cu1 Ru6 Ru7 56.13(5) . . ?
Cu1 Ru6 Ru7 146.42(7) . 2_756 ?
C17 Ru6 Te2 90.3(5) . 2_756 ?
C17 Ru6 Te2 169.8(4) . . ?
C17 Ru6 Ru7 112.5(4) . . ?
C17 Ru6 Ru7 124.0(5) . 2_756 ?
C17 Ru6 Cu1 75.5(5) . . ?
C17 Ru6 C19 93.3(7) . . ?
C18 Ru6 Te2 173.6(5) . 2_756 ?
C18 Ru6 Te2 91.1(5) . . ?
C18 Ru6 Ru7 121.0(5) . 2_756 ?
C18 Ru6 Ru7 116.6(5) . . ?
C18 Ru6 Cu1 79.5(5) . . ?
C18 Ru6 C17 94.2(7) . . ?
C18 Ru6 C19 94.9(7) . . ?
C19 Ru6 Te2 94.8(5) . . ?
C19 Ru6 Te2 89.3(5) . 2_756 ?
C19 Ru6 Ru7 46.2(5) . 2_756 ?
C19 Ru6 Ru7 136.2(5) . . ?
C19 Ru6 Cu1 166.9(5) . . ?
Te2 Ru7 Te2 83.47(5) . 2_756 ?
Te2 Ru7 Ru6 57.07(4) . . ?
Te2 Ru7 Ru6 57.10(4) 2_756 . ?
Te2 Ru7 Ru6 59.08(4) . 2_756 ?
Te2 Ru7 Ru6 59.02(4) 2_756 2_756 ?
Ru6 Ru7 Ru6 89.71(5) 2_756 . ?
Cu1 Ru7 Te2 97.29(6) . . ?
Cu1 Ru7 Te2 97.61(7) . 2_756 ?
Cu1 Ru7 Ru6 56.74(5) . . ?
Cu1 Ru7 Ru6 146.44(7) . 2_756 ?
C15 Ru7 Te2 91.5(5) . 2_756 ?
C15 Ru7 Te2 173.8(4) . . ?
C15 Ru7 Ru6 117.0(5) . . ?
C15 Ru7 Ru6 121.2(5) . 2_756 ?
C15 Ru7 Cu1 79.7(5) . . ?
C15 Ru7 C19 94.8(7) . 2_756 ?
C16 Ru7 Te2 169.9(5) . 2_756 ?
C16 Ru7 Te2 92.6(5) . . ?
C16 Ru7 Ru6 126.4(5) . 2_756 ?
C16 Ru7 Ru6 113.0(5) . . ?
C16 Ru7 Cu1 73.6(5) . . ?
C16 Ru7 C15 91.7(7) . . ?
C16 Ru7 C19 94.5(7) . 2_756 ?
C19 Ru7 Te2 94.8(5) 2_756 2_756 ?
C19 Ru7 Te2 89.3(5) 2_756 . ?
C19 Ru7 Ru6 46.4(4) 2_756 2_756 ?
C19 Ru7 Ru6 135.8(4) 2_756 . ?
C19 Ru7 Cu1 166.6(5) 2_756 . ?
Ru4 Cu1 Te1 57.72(5) . . ?
Ru4 Cu1 Ru6 147.40(9) . . ?
Ru4 Cu1 Ru7 133.04(9) . . ?
Ru6 Cu1 Te1 101.73(7) . . ?
Ru7 Cu1 Te1 168.66(8) . . ?
Ru7 Cu1 Ru6 67.13(6) . . ?
O1 C1 Ru1 176.2(16) . . ?
O2 C2 Ru1 176.8(16) . . ?
Ru1 C3 Ru2 85.4(6) . . ?
O3 C3 Ru1 140.9(12) . . ?
O3 C3 Ru2 133.6(12) . . ?
O4 C4 Ru2 176.2(14) . . ?
O5 C5 Ru2 174.9(14) . . ?
Ru3 C6 Ru2 83.1(6) . . ?
O6 C6 Ru2 129.2(12) . . ?
O6 C6 Ru3 147.5(13) . . ?
O7 C7 Ru3 173.4(16) . . ?
O8 C8 Ru3 173.6(17) . . ?
O9 C9 Ru4 176.7(14) . . ?
O10 C10 Ru4 174.0(14) . . ?
Ru4 C11 Ru5 77.7(5) . . ?
O11 C11 Ru4 152.6(13) . . ?
O11 C11 Ru5 124.6(12) . . ?
O12 C12 Ru5 173.8(14) . . ?
O13 C13 Ru5 175.1(14) . . ?
O14 C14 Ru5 171.6(14) . . ?
O15 C15 Ru7 176.4(15) . . ?
O16 C16 Ru7 175.9(16) . . ?
O17 C17 Ru6 174.7(16) . . ?
O18 C18 Ru6 176.3(15) . . ?
Ru7 C19 Ru6 87.4(6) 2_756 . ?
O19 C19 Ru6 136.6(13) . . ?
O19 C19 Ru7 135.6(12) . 2_756 ?
C44 P2 C50 108.5(8) . . ?
C44 P2 C56 110.0(7) . . ?
C50 P2 C56 107.6(8) . . ?
C62 P2 C44 110.2(8) . . ?
C62 P2 C50 109.9(7) . . ?
C62 P2 C56 110.6(7) . . ?
C45 C44 P2 121.7(15) . . ?
C49 C44 P2 119.4(15) . . ?
C49 C44 C45 118.8(18) . . ?
C44 C45 C46 119(2) . . ?
C47 C46 C45 120(2) . . ?
C48 C47 C46 122(2) . . ?
C47 C48 C49 118(2) . . ?
C44 C49 C48 122(2) . . ?
C51 C50 P2 118.8(13) . . ?
C55 C50 P2 120.3(14) . . ?
C55 C50 C51 120.4(16) . . ?
C50 C51 C52 120.9(16) . . ?
C53 C52 C51 118.1(17) . . ?
C54 C53 C52 121.9(17) . . ?
C53 C54 C55 118.8(18) . . ?
C50 C55 C54 119.7(17) . . ?
C57 C56 P2 119.2(13) . . ?
C61 C56 P2 123.4(12) . . ?
C61 C56 C57 117.4(16) . . ?
C58 C57 C56 121.1(18) . . ?
C57 C58 C59 118.2(17) . . ?
C60 C59 C58 121.9(18) . . ?
C59 C60 C61 116.6(18) . . ?
C56 C61 C60 124.8(17) . . ?
C63 C62 P2 120.5(12) . . ?
C67 C62 P2 120.1(12) . . ?
C67 C62 C63 119.4(14) . . ?
C62 C63 C64 120.1(15) . . ?
C65 C64 C63 116.8(15) . . ?
C66 C65 C64 123.6(17) . . ?
C65 C66 C67 119.8(17) . . ?
C62 C67 C66 120.1(15) . . ?
C20 P1 C26 109.8(7) . . ?
C20 P1 C32 111.4(6) . . ?
C26 P1 C32 109.1(7) . . ?
C38 P1 C20 109.7(7) . . ?
C38 P1 C26 109.2(6) . . ?
C38 P1 C32 107.7(6) . . ?
C21 C20 P1 118.3(12) . . ?
C21 C20 C25 121.0(15) . . ?
C25 C20 P1 120.8(13) . . ?
C20 C21 C22 118.8(15) . . ?
C23 C22 C21 120.6(17) . . ?
C24 C23 C22 118.8(17) . . ?
C23 C24 C25 121.9(17) . . ?
C24 C25 C20 118.9(17) . . ?
C27 C26 P1 122.1(12) . . ?
C27 C26 C31 119.1(14) . . ?
C31 C26 P1 118.7(11) . . ?
C26 C27 C28 120.5(15) . . ?
C29 C28 C27 120.5(16) . . ?
C28 C29 C30 119.7(16) . . ?
C31 C30 C29 121.1(17) . . ?
C30 C31 C26 119.0(15) . . ?
C33 C32 P1 117.6(10) . . ?
C37 C32 P1 123.4(12) . . ?
C37 C32 C33 118.8(13) . . ?
C34 C33 C32 118.8(14) . . ?
C35 C34 C33 121.1(16) . . ?
C34 C35 C36 121.4(15) . . ?
C35 C36 C37 118.4(15) . . ?
C32 C37 C36 121.4(15) . . ?
C39 C38 P1 123.9(11) . . ?
C39 C38 C43 116.2(14) . . ?
C43 C38 P1 119.9(11) . . ?
C40 C39 C38 122.1(15) . . ?
C39 C40 C41 120.1(16) . . ?
C40 C41 C42 121.8(17) . . ?
C43 C42 C41 117.9(16) . . ?
C42 C43 C38 122.0(15) . . ?
C69 O20 C70 108(2) . . ?
C68 C69 O20 102(3) . . ?
C71 C70 O20 107(2) . . ?
C72 O21 C74 78(6) . . ?
C72 O21 C74 65(6) . 2_766 ?
C73 O21 C72 141(6) 2_766 . ?
C73 O21 C74 81(6) 2_766 . ?
C73 O21 C74 80(7) 2_766 2_766 ?
C74 O21 C74 80(8) 2_766 . ?
O21 C72 C74 53(5) . . ?
O21 C72 C74 58(6) . 2_766 ?
O21 C72 C75 130(7) . 2_766 ?
C73 C72 O21 114(7) . . ?
C73 C72 C74 78(7) . 2_766 ?
C73 C72 C74 65(6) . . ?
C73 C72 C75 57(5) . 2_766 ?
C74 C72 C74 68(8) 2_766 . ?
C75 C72 C74 72(7) 2_766 2_766 ?
C75 C72 C74 114(8) 2_766 . ?
O21 C73 C72 100(5) 2_766 . ?
O21 C73 C74 53(5) 2_766 2_766 ?
O21 C73 C74 52(5) 2_766 . ?
O21 C73 C75 107(6) 2_766 2_766 ?
C72 C73 C74 54(5) . 2_766 ?
C72 C73 C74 69(6) . . ?
C74 C73 C74 63(7) . 2_766 ?
C75 C73 C72 64(5) 2_766 . ?
C75 C73 C74 64(5) 2_766 2_766 ?
C75 C73 C74 123(7) 2_766 . ?
O21 C74 O21 100(8) 2_766 . ?
O21 C74 C72 49(4) . . ?
O21 C74 C72 57(6) 2_766 2_766 ?
O21 C74 C72 79(7) 2_766 . ?
O21 C74 C72 88(7) . 2_766 ?
O21 C74 C73 91(7) . . ?
O21 C74 C73 46(4) . 2_766 ?
O21 C74 C73 91(6) 2_766 2_766 ?
O21 C74 C73 48(5) 2_766 . ?
O21 C74 C74 48(6) . 2_766 ?
O21 C74 C74 52(6) 2_766 2_766 ?
O21 C74 C75 83(7) . . ?
O21 C74 C75 109(9) 2_766 . ?
C72 C74 C72 112(8) 2_766 . ?
C72 C74 C73 90(6) . 2_766 ?
C72 C74 C73 103(9) 2_766 . ?
C72 C74 C73 48(4) 2_766 2_766 ?
C72 C74 C74 48(6) . 2_766 ?
C72 C74 C74 64(7) 2_766 2_766 ?
C72 C74 C75 52(6) 2_766 . ?
C73 C74 C72 45(4) . . ?
C73 C74 C73 117(7) . 2_766 ?
C73 C74 C74 60(7) . 2_766 ?
C73 C74 C74 57(6) 2_766 2_766 ?
C75 C74 C72 132(8) . . ?
C75 C74 C73 44(4) . 2_766 ?
C75 C74 C73 155(9) . . ?
C75 C74 C74 99(9) . 2_766 ?
C72 C75 C74 56(5) 2_766 . ?
C73 C75 C72 60(5) 2_766 2_766 ?
C73 C75 C74 72(6) 2_766 . ?

_shelx_SHELXL_version_number     2014/7

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

data_3a

_database_code_depnum_ccdc_archive 'CCDC 1029050'
_audit_update_record             
;
2015-02-17 deposited with the CCDC.
2015-02-26 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C18 H6 Cu2 N2 O14 Ru5 Te'
_chemical_formula_sum            'C18 H6 Cu2 N2 O14 Ru5 Te'
_chemical_formula_weight         1234.28

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'
Cu Cu 0.3201 1.2651 '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'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 21/n'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   15.2231(3)
_cell_length_b                   10.4337(2)
_cell_length_c                   19.5749(5)
_cell_angle_alpha                90.00
_cell_angle_beta                 107.9740(10)
_cell_angle_gamma                90.00
_cell_volume                     2957.41(11)
_cell_formula_units_Z            4
_cell_measurement_temperature    200(2)
_cell_measurement_reflns_used    0
_cell_measurement_theta_min      0
_cell_measurement_theta_max      0

_exptl_crystal_description       prism
_exptl_crystal_colour            black
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.10
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.772
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2280
_exptl_absorpt_coefficient_mu    4.927
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.3016
_exptl_absorpt_correction_T_max  0.6386
_exptl_absorpt_process_details   'SADABS, 2003'

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      200(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            19753
_diffrn_reflns_av_R_equivalents  0.0248
_diffrn_reflns_av_unetI/netI     0.0226
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         2.24
_diffrn_reflns_theta_max         25.05
_reflns_number_total             5203
_reflns_number_gt                4747
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1986)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (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)+(0.0135P)²+1.9534P] 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         5203
_refine_ls_number_parameters     381
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0211
_refine_ls_R_factor_gt           0.0175
_refine_ls_wR_factor_ref         0.0389
_refine_ls_wR_factor_gt          0.0373
_refine_ls_goodness_of_fit_ref   1.068
_refine_ls_restrained_S_all      1.068
_refine_ls_shift/su_max          0.035
_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 0.4560(2) 0.1413(3) 0.19600(15) 0.0225(6) Uani 1 1 d . . .
C2 C 0.3053(2) -0.0429(3) 0.15457(16) 0.0256(7) Uani 1 1 d . . .
C3 C 0.4141(2) -0.0115(3) 0.07417(16) 0.0278(7) Uani 1 1 d . . .
C4 C 0.1312(2) 0.0557(3) 0.01031(17) 0.0302(7) Uani 1 1 d . . .
C5 C 0.15555(19) 0.2342(3) -0.08677(17) 0.0255(7) Uani 1 1 d . . .
C6 C 0.0599(2) 0.3024(3) 0.00954(16) 0.0280(7) Uani 1 1 d . . .
C7 C 0.2364(2) 0.6208(3) 0.05179(17) 0.0291(7) Uani 1 1 d . . .
C8 C 0.1507(2) 0.5233(3) 0.13809(18) 0.0315(7) Uani 1 1 d . . .
C9 C 0.3518(2) 0.5275(3) 0.18158(16) 0.0260(7) Uani 1 1 d . . .
C10 C 0.41725(19) 0.3389(3) 0.28805(17) 0.0265(7) Uani 1 1 d . . .
C11 C 0.5173(2) 0.3986(3) 0.20116(15) 0.0260(7) Uani 1 1 d . . .
C12 C 0.4081(2) 0.4974(3) 0.04543(17) 0.0286(7) Uani 1 1 d . . .
C13 C 0.4819(2) 0.2583(3) 0.06296(15) 0.0242(7) Uani 1 1 d . . .
C14 C 0.3494(2) 0.3190(3) -0.06533(17) 0.0325(8) Uani 1 1 d . . .
C15 C 0.2847(2) -0.0659(3) -0.15548(18) 0.0380(9) Uani 1 1 d . . .
C16 C 0.2727(3) -0.1499(4) -0.2167(2) 0.0596(12) Uani 1 1 d . . .
H16A H 0.3189 -0.1293 -0.2404 0.089 Uiso 1 1 calc R . .
H16B H 0.2107 -0.1380 -0.2506 0.089 Uiso 1 1 calc R . .
H16C H 0.2803 -0.2392 -0.2003 0.089 Uiso 1 1 calc R . .
C17 C 0.0997(2) 0.6170(3) -0.1606(2) 0.0410(9) Uani 1 1 d . . .
C18 C 0.0366(3) 0.6971(4) -0.2152(2) 0.0729(15) Uani 1 1 d . . .
H18A H -0.0268 0.6664 -0.2242 0.109 Uiso 1 1 calc R . .
H18B H 0.0530 0.6925 -0.2598 0.109 Uiso 1 1 calc R . .
H18C H 0.0411 0.7860 -0.1984 0.109 Uiso 1 1 calc R . .
N1 N 0.29353(19) -0.0023(3) -0.10715(15) 0.0376(7) Uani 1 1 d . . .
N2 N 0.14698(18) 0.5558(3) -0.11785(15) 0.0343(7) Uani 1 1 d . . .
O1 O 0.52352(14) 0.0930(2) 0.23147(12) 0.0335(5) Uani 1 1 d . . .
O2 O 0.28199(17) -0.1290(2) 0.18066(13) 0.0441(6) Uani 1 1 d . . .
O3 O 0.46255(17) -0.0828(2) 0.06064(13) 0.0463(6) Uani 1 1 d . . .
O4 O 0.09973(16) -0.0433(2) 0.00441(15) 0.0489(7) Uani 1 1 d . . .
O5 O 0.13470(15) 0.2287(2) -0.14818(12) 0.0370(6) Uani 1 1 d . . .
O6 O -0.01053(16) 0.3421(2) 0.00630(14) 0.0489(7) Uani 1 1 d . . .
O7 O 0.23425(17) 0.7223(2) 0.02962(13) 0.0445(6) Uani 1 1 d . . .
O8 O 0.09365(18) 0.5564(2) 0.16037(15) 0.0525(7) Uani 1 1 d . . .
O9 O 0.38407(15) 0.6195(2) 0.21272(13) 0.0436(6) Uani 1 1 d . . .
O10 O 0.43179(16) 0.3500(2) 0.34802(12) 0.0452(6) Uani 1 1 d . . .
O11 O 0.58926(15) 0.4420(2) 0.21114(13) 0.0431(6) Uani 1 1 d . . .
O12 O 0.44269(16) 0.5950(2) 0.05030(14) 0.0446(6) Uani 1 1 d . . .
O13 O 0.55721(14) 0.2271(2) 0.07810(12) 0.0362(5) Uani 1 1 d . . .
O14 O 0.35300(17) 0.3201(3) -0.12313(12) 0.0536(7) Uani 1 1 d . . .
Cu1 Cu 0.30307(3) 0.10188(4) -0.02563(2) 0.02862(9) Uani 1 1 d . . .
Cu2 Cu 0.20732(3) 0.44959(4) -0.03773(2) 0.02750(9) Uani 1 1 d . . .
Ru1 Ru 0.343656(15) 0.10006(2) 0.113250(12) 0.01676(6) Uani 1 1 d . . .
Ru2 Ru 0.175906(14) 0.22790(2) 0.014343(12) 0.01718(6) Uani 1 1 d . . .
Ru3 Ru 0.244316(15) 0.46415(2) 0.102202(12) 0.01877(6) Uani 1 1 d . . .
Ru4 Ru 0.399593(15) 0.33113(2) 0.187468(12) 0.01681(6) Uani 1 1 d . . .
Ru5 Ru 0.361059(14) 0.32755(2) 0.034472(12) 0.01638(6) Uani 1 1 d . . .
Te1 Te 0.222533(12) 0.235654(18) 0.157557(10) 0.02001(5) 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 O1 1.162(3) . ?
C1 Ru1 2.006(3) . ?
C1 Ru4 2.145(3) . ?
C2 O2 1.143(3) . ?
C2 Ru1 1.874(3) . ?
C3 O3 1.135(4) . ?
C3 Ru1 1.897(3) . ?
C3 Cu1 2.457(3) . ?
C4 O4 1.130(4) . ?
C4 Ru2 1.914(3) . ?
C5 O5 1.146(4) . ?
C5 Ru2 1.908(3) . ?
C5 Cu2 2.475(3) . ?
C6 O6 1.132(4) . ?
C6 Ru2 1.906(3) . ?
C7 O7 1.141(4) . ?
C7 Ru3 1.894(3) . ?
C7 Cu2 2.445(3) . ?
C8 O8 1.139(4) . ?
C8 Ru3 1.877(3) . ?
C9 O9 1.162(3) . ?
C9 Ru3 1.989(3) . ?
C9 Ru4 2.165(3) . ?
C10 O10 1.131(4) . ?
C10 Ru4 1.905(3) . ?
C11 O11 1.145(3) . ?
C11 Ru4 1.865(3) . ?
C12 O12 1.137(4) . ?
C12 Ru5 1.898(3) . ?
C13 O13 1.139(3) . ?
C13 Ru5 1.893(3) . ?
C14 O14 1.149(4) . ?
C14 Ru5 1.909(3) . ?
C15 N1 1.130(4) . ?
C15 C16 1.449(5) . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 N2 1.121(4) . ?
C17 C18 1.460(5) . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
N1 Cu1 1.899(3) . ?
N2 Cu2 1.908(3) . ?
Cu1 Ru1 2.5953(4) . ?
Cu1 Ru2 2.6502(4) . ?
Cu1 Ru5 2.6583(4) . ?
Cu2 Ru3 2.6250(4) . ?
Cu2 Ru2 2.6304(4) . ?
Cu2 Ru5 2.6560(4) . ?
Ru1 Te1 2.6721(3) . ?
Ru1 Ru4 2.8079(3) . ?
Ru1 Ru5 2.8869(3) . ?
Ru1 Ru2 2.9995(3) . ?
Ru2 Te1 2.6723(3) . ?
Ru2 Ru5 2.9147(3) . ?
Ru2 Ru3 3.0022(3) . ?
Ru3 Te1 2.6814(3) . ?
Ru3 Ru4 2.8044(3) . ?
Ru3 Ru5 2.8986(3) . ?
Ru4 Te1 2.7616(3) . ?
Ru4 Ru5 2.8689(3) . ?

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
O1 C1 Ru1 140.0(2) . . ?
O1 C1 Ru4 134.9(2) . . ?
Ru1 C1 Ru4 85.05(11) . . ?
O2 C2 Ru1 179.0(3) . . ?
O3 C3 Ru1 170.2(3) . . ?
O3 C3 Cu1 117.9(2) . . ?
Ru1 C3 Cu1 71.89(10) . . ?
O4 C4 Ru2 175.4(3) . . ?
O5 C5 Ru2 172.0(3) . . ?
O5 C5 Cu2 113.8(2) . . ?
Ru2 C5 Cu2 72.45(10) . . ?
O6 C6 Ru2 177.4(3) . . ?
O7 C7 Ru3 171.5(3) . . ?
O7 C7 Cu2 115.3(2) . . ?
Ru3 C7 Cu2 73.21(10) . . ?
O8 C8 Ru3 178.4(3) . . ?
O9 C9 Ru3 142.8(2) . . ?
O9 C9 Ru4 132.3(2) . . ?
Ru3 C9 Ru4 84.79(11) . . ?
O10 C10 Ru4 175.4(3) . . ?
O11 C11 Ru4 178.1(3) . . ?
O12 C12 Ru5 173.9(3) . . ?
O13 C13 Ru5 173.6(3) . . ?
O14 C14 Ru5 171.7(3) . . ?
N1 C15 C16 178.7(4) . . ?
C15 C16 H16A 109.5 . . ?
C15 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C15 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
N2 C17 C18 178.6(5) . . ?
C17 C18 H18A 109.5 . . ?
C17 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C17 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C15 N1 Cu1 177.3(3) . . ?
C17 N2 Cu2 168.6(3) . . ?
N1 Cu1 C3 104.37(11) . . ?
N1 Cu1 Ru1 143.89(9) . . ?
C3 Cu1 Ru1 43.99(7) . . ?
N1 Cu1 Ru2 131.20(8) . . ?
C3 Cu1 Ru2 112.97(8) . . ?
Ru1 Cu1 Ru2 69.747(11) . . ?
N1 Cu1 Ru5 143.87(9) . . ?
C3 Cu1 Ru5 91.22(7) . . ?
Ru1 Cu1 Ru5 66.653(11) . . ?
Ru2 Cu1 Ru5 66.607(11) . . ?
N2 Cu2 C7 95.71(11) . . ?
N2 Cu2 C5 101.15(11) . . ?
C7 Cu2 C5 155.07(11) . . ?
N2 Cu2 Ru3 135.87(9) . . ?
C7 Cu2 Ru3 43.68(8) . . ?
C5 Cu2 Ru3 113.41(8) . . ?
N2 Cu2 Ru2 136.89(8) . . ?
C7 Cu2 Ru2 112.28(8) . . ?
C5 Cu2 Ru2 43.75(8) . . ?
Ru3 Cu2 Ru2 69.677(11) . . ?
N2 Cu2 Ru5 146.85(9) . . ?
C7 Cu2 Ru5 91.96(7) . . ?
C5 Cu2 Ru5 83.91(7) . . ?
Ru3 Cu2 Ru5 66.575(11) . . ?
Ru2 Cu2 Ru5 66.919(11) . . ?
C2 Ru1 C3 88.62(13) . . ?
C2 Ru1 C1 97.10(12) . . ?
C3 Ru1 C1 90.54(12) . . ?
C2 Ru1 Cu1 116.92(9) . . ?
C3 Ru1 Cu1 64.12(9) . . ?
C1 Ru1 Cu1 135.42(8) . . ?
C2 Ru1 Te1 86.76(9) . . ?
C3 Ru1 Te1 171.36(9) . . ?
C1 Ru1 Te1 97.26(8) . . ?
Cu1 Ru1 Te1 111.780(11) . . ?
C2 Ru1 Ru4 123.05(9) . . ?
C3 Ru1 Ru4 128.06(9) . . ?
C1 Ru1 Ru4 49.57(8) . . ?
Cu1 Ru1 Ru4 118.154(12) . . ?
Te1 Ru1 Ru4 60.460(8) . . ?
C2 Ru1 Ru5 167.75(9) . . ?
C3 Ru1 Ru5 97.61(9) . . ?
C1 Ru1 Ru5 93.40(8) . . ?
Cu1 Ru1 Ru5 57.717(11) . . ?
Te1 Ru1 Ru5 85.661(9) . . ?
Ru4 Ru1 Ru5 60.481(8) . . ?
C2 Ru1 Ru2 108.43(9) . . ?
C3 Ru1 Ru2 119.17(9) . . ?
C1 Ru1 Ru2 140.34(8) . . ?
Cu1 Ru1 Ru2 55.986(10) . . ?
Te1 Ru1 Ru2 55.861(7) . . ?
Ru4 Ru1 Ru2 90.804(9) . . ?
Ru5 Ru1 Ru2 59.324(7) . . ?
C6 Ru2 C5 94.79(13) . . ?
C6 Ru2 C4 93.91(13) . . ?
C5 Ru2 C4 92.73(13) . . ?
C6 Ru2 Cu2 84.19(9) . . ?
C5 Ru2 Cu2 63.80(9) . . ?
C4 Ru2 Cu2 156.09(10) . . ?
C6 Ru2 Cu1 159.77(9) . . ?
C5 Ru2 Cu1 67.07(9) . . ?
C4 Ru2 Cu1 78.77(10) . . ?
Cu2 Ru2 Cu1 94.884(14) . . ?
C6 Ru2 Te1 88.94(9) . . ?
C5 Ru2 Te1 173.16(9) . . ?
C4 Ru2 Te1 92.73(10) . . ?
Cu2 Ru2 Te1 111.019(12) . . ?
Cu1 Ru2 Te1 110.059(11) . . ?
C6 Ru2 Ru5 134.77(9) . . ?
C5 Ru2 Ru5 88.21(8) . . ?
C4 Ru2 Ru5 131.09(9) . . ?
Cu2 Ru2 Ru5 56.962(10) . . ?
Cu1 Ru2 Ru5 56.830(10) . . ?
Te1 Ru2 Ru5 85.104(8) . . ?
C6 Ru2 Ru1 143.60(9) . . ?
C5 Ru2 Ru1 121.22(9) . . ?
C4 Ru2 Ru1 80.24(9) . . ?
Cu2 Ru2 Ru1 114.882(11) . . ?
Cu1 Ru2 Ru1 54.267(10) . . ?
Te1 Ru2 Ru1 55.856(7) . . ?
Ru5 Ru2 Ru1 58.413(7) . . ?
C6 Ru2 Ru3 81.13(9) . . ?
C5 Ru2 Ru3 118.86(9) . . ?
C4 Ru2 Ru3 148.25(10) . . ?
Cu2 Ru2 Ru3 55.078(10) . . ?
Cu1 Ru2 Ru3 114.873(12) . . ?
Te1 Ru2 Ru3 56.034(7) . . ?
Ru5 Ru2 Ru3 58.642(7) . . ?
Ru1 Ru2 Ru3 85.389(8) . . ?
C8 Ru3 C7 88.70(14) . . ?
C8 Ru3 C9 97.73(13) . . ?
C7 Ru3 C9 91.45(12) . . ?
C8 Ru3 Cu2 117.80(10) . . ?
C7 Ru3 Cu2 63.10(9) . . ?
C9 Ru3 Cu2 133.96(9) . . ?
C8 Ru3 Te1 86.47(10) . . ?
C7 Ru3 Te1 169.11(9) . . ?
C9 Ru3 Te1 98.86(9) . . ?
Cu2 Ru3 Te1 110.899(12) . . ?
C8 Ru3 Ru4 122.54(10) . . ?
C7 Ru3 Ru4 130.08(9) . . ?
C9 Ru3 Ru4 50.26(8) . . ?
Cu2 Ru3 Ru4 117.542(12) . . ?
Te1 Ru3 Ru4 60.401(8) . . ?
C8 Ru3 Ru5 167.52(10) . . ?
C7 Ru3 Ru5 97.80(9) . . ?
C9 Ru3 Ru5 92.76(9) . . ?
Cu2 Ru3 Ru5 57.225(10) . . ?
Te1 Ru3 Ru5 85.261(8) . . ?
Ru4 Ru3 Ru5 60.377(8) . . ?
C8 Ru3 Ru2 108.38(10) . . ?
C7 Ru3 Ru2 117.07(9) . . ?
C9 Ru3 Ru2 140.93(8) . . ?
Cu2 Ru3 Ru2 55.245(10) . . ?
Te1 Ru3 Ru2 55.747(7) . . ?
Ru4 Ru3 Ru2 90.816(9) . . ?
Ru5 Ru3 Ru2 59.170(7) . . ?
C11 Ru4 C10 90.71(12) . . ?
C11 Ru4 C1 89.63(12) . . ?
C10 Ru4 C1 91.91(12) . . ?
C11 Ru4 C9 86.72(12) . . ?
C10 Ru4 C9 87.29(12) . . ?
C1 Ru4 C9 176.26(11) . . ?
C11 Ru4 Te1 176.14(9) . . ?
C10 Ru4 Te1 92.96(9) . . ?
C1 Ru4 Te1 91.41(8) . . ?
C9 Ru4 Te1 92.28(8) . . ?
C11 Ru4 Ru3 119.63(9) . . ?
C10 Ru4 Ru3 114.73(9) . . ?
C1 Ru4 Ru3 138.34(8) . . ?
C9 Ru4 Ru3 44.95(8) . . ?
Te1 Ru4 Ru3 57.592(7) . . ?
C11 Ru4 Ru1 121.52(9) . . ?
C10 Ru4 Ru1 119.66(9) . . ?
C1 Ru4 Ru1 45.38(8) . . ?
C9 Ru4 Ru1 137.86(8) . . ?
Te1 Ru4 Ru1 57.335(7) . . ?
Ru3 Ru4 Ru1 92.961(9) . . ?
C11 Ru4 Ru5 91.88(9) . . ?
C10 Ru4 Ru5 176.12(9) . . ?
C1 Ru4 Ru5 90.99(8) . . ?
C9 Ru4 Ru5 89.98(8) . . ?
Te1 Ru4 Ru5 84.388(8) . . ?
Ru3 Ru4 Ru5 61.437(8) . . ?
Ru1 Ru4 Ru5 61.122(8) . . ?
C13 Ru5 C12 91.41(13) . . ?
C13 Ru5 C14 93.35(13) . . ?
C12 Ru5 C14 94.13(14) . . ?
C13 Ru5 Cu2 163.00(9) . . ?
C12 Ru5 Cu2 81.51(9) . . ?
C14 Ru5 Cu2 71.92(10) . . ?
C13 Ru5 Cu1 87.25(9) . . ?
C12 Ru5 Cu1 159.87(10) . . ?
C14 Ru5 Cu1 65.93(10) . . ?
Cu2 Ru5 Cu1 94.094(13) . . ?
C13 Ru5 Ru4 80.24(9) . . ?
C12 Ru5 Ru4 85.49(10) . . ?
C14 Ru5 Ru4 173.56(9) . . ?
Cu2 Ru5 Ru4 114.329(12) . . ?
Cu1 Ru5 Ru4 113.986(12) . . ?
C13 Ru5 Ru1 76.69(9) . . ?
C12 Ru5 Ru1 143.19(9) . . ?
C14 Ru5 Ru1 120.89(10) . . ?
Cu2 Ru5 Ru1 117.862(12) . . ?
Cu1 Ru5 Ru1 55.630(10) . . ?
Ru4 Ru5 Ru1 58.397(7) . . ?
C13 Ru5 Ru3 136.90(9) . . ?
C12 Ru5 Ru3 75.67(9) . . ?
C14 Ru5 Ru3 127.95(10) . . ?
Cu2 Ru5 Ru3 56.200(10) . . ?
Cu1 Ru5 Ru3 118.114(12) . . ?
Ru4 Ru5 Ru3 58.186(8) . . ?
Ru1 Ru5 Ru3 89.408(9) . . ?
C13 Ru5 Ru2 135.63(9) . . ?
C12 Ru5 Ru2 131.58(9) . . ?
C14 Ru5 Ru2 93.70(9) . . ?
Cu2 Ru5 Ru2 56.119(10) . . ?
Cu1 Ru5 Ru2 56.563(10) . . ?
Ru4 Ru5 Ru2 91.343(9) . . ?
Ru1 Ru5 Ru2 62.263(8) . . ?
Ru3 Ru5 Ru2 62.187(8) . . ?
Ru1 Te1 Ru2 68.284(8) . . ?
Ru1 Te1 Ru3 98.963(9) . . ?
Ru2 Te1 Ru3 68.219(8) . . ?
Ru1 Te1 Ru4 62.204(8) . . ?
Ru2 Te1 Ru4 99.164(9) . . ?
Ru3 Te1 Ru4 62.007(7) . . ?

_diffrn_measured_fraction_theta_max 0.994
_diffrn_reflns_theta_full        25.05
_diffrn_measured_fraction_theta_full 0.994
_refine_diff_density_max         0.420
_refine_diff_density_min         -0.474
_refine_diff_density_rms         0.086
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_3b

_database_code_depnum_ccdc_archive 'CCDC 1029051'
_audit_update_record             
;
2015-02-17 deposited with the CCDC.
2015-02-26 downloaded from the CCDC.
;

_audit_creation_date             2015-02-09
_audit_creation_method           
; ?
;
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C18 H6 Cu2 N2 O14 Ru5 Te,0.5(C H2 Cl2)'
_chemical_formula_sum            'C18.5 H7 Cl Cu2 N2 O14 Ru5 Te'
_chemical_formula_weight         1276.74
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0030 0.0020 '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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu 0.3200 1.2650 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0060 0.0030 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0110 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2590 0.8360 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Te Te -0.5310 1.6750 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   14.3956(12)
_cell_length_b                   11.7755(10)
_cell_length_c                   19.1746(17)
_cell_angle_alpha                90
_cell_angle_beta                 105.493(1)
_cell_angle_gamma                90
_cell_volume                     3132.3(5)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    ?
_cell_measurement_temperature    200(2)
_cell_measurement_theta_max      ?
_cell_measurement_theta_min      ?
_shelx_estimated_absorpt_T_max   0.703
_shelx_estimated_absorpt_T_min   0.266
_exptl_absorpt_coefficient_mu    4.739
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.2709
_exptl_absorpt_correction_T_max  0.7073
_exptl_absorpt_process_details   'SADABS, 2003'
_exptl_crystal_description       prism
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    2.707
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2364
_exptl_crystal_size_max          0.38
_exptl_crystal_size_mid          0.3
_exptl_crystal_size_min          0.08
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0486
_diffrn_reflns_av_unetI/netI     0.0464
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            21230
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.107
_diffrn_reflns_theta_max         25.107
_diffrn_reflns_theta_min         2.051
_diffrn_ambient_temperature      200(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       'CCD rotation images, wide frames'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                4556
_reflns_number_total             5559
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL 2014/7 (Sheldrick, 2008)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_refine_diff_density_max         1.734
_refine_diff_density_min         -2.291
_refine_diff_density_rms         0.601
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.127
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     406
_refine_ls_number_reflns         5559
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0427
_refine_ls_R_factor_gt           0.0284
_refine_ls_restrained_S_all      1.127
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0520P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0717
_refine_ls_wR_factor_ref         0.1011
_refine_special_details          
; The CH₂Cl₂ molecule of crustallisation is disordered 
between two positions related by an inversion centre.
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.2545(5) 0.7275(6) 0.1316(4) 0.0329(17) Uani 1 1 d . . . . .
C2 C 0.0488(5) 0.7119(6) 0.0953(3) 0.0268(15) Uani 1 1 d . . . . .
C3 C 0.1502(5) 0.7073(6) 0.2325(4) 0.0272(15) Uani 1 1 d . . . . .
C4 C -0.0029(5) 0.3136(6) 0.1038(3) 0.0275(15) Uani 1 1 d . . . . .
C5 C 0.0945(5) 0.3122(6) 0.2409(3) 0.0266(15) Uani 1 1 d . . . . .
C6 C 0.1862(5) 0.2237(6) 0.1410(4) 0.0336(17) Uani 1 1 d . . . . .
C7 C 0.3775(5) 0.2334(7) 0.1477(4) 0.0411(19) Uani 1 1 d . . . . .
C8 C 0.2543(5) 0.2528(6) 0.0105(4) 0.0356(17) Uani 1 1 d . . . . .
C9 C 0.3863(5) 0.4342(6) 0.0685(4) 0.0337(17) Uani 1 1 d . . . . .
C10 C 0.4294(5) 0.6405(6) 0.1386(4) 0.0361(18) Uani 1 1 d . . . . .
C11 C 0.3056(5) 0.6462(7) 0.0020(4) 0.0380(18) Uani 1 1 d . . . . .
C12 C 0.3038(5) 0.3536(7) 0.2923(4) 0.0359(18) Uani 1 1 d . . . . .
C13 C 0.4382(5) 0.4429(6) 0.2326(4) 0.0327(17) Uani 1 1 d . . . . .
C14 C 0.3357(5) 0.5941(7) 0.2915(4) 0.041(2) Uani 1 1 d . . . . .
C15 C -0.2108(6) 0.5120(6) 0.1738(5) 0.0406(19) Uani 1 1 d . . . . .
C16 C -0.3039(6) 0.4905(8) 0.1888(6) 0.063(3) Uani 1 1 d . . . . .
H16A H -0.3125 0.4085 0.1926 0.096 Uiso 1 1 d . . . . .
H16B H -0.3556 0.5200 0.1478 0.096 Uiso 1 1 d . . . . .
H16C H -0.3053 0.5286 0.2328 0.096 Uiso 1 1 d . . . . .
C17 C 0.1334(7) 0.5265(7) 0.4209(5) 0.049(2) Uani 1 1 d . . . . .
C18 C 0.1398(11) 0.5315(9) 0.4978(5) 0.099(5) Uani 1 1 d . . . . .
H18A H 0.1026 0.5988 0.5078 0.141 Uiso 1 1 d . . . . .
H18B H 0.2050 0.5364 0.5277 0.141 Uiso 1 1 d . . . . .
H18C H 0.1080 0.4631 0.5121 0.141 Uiso 1 1 d . . . . .
N1 N -0.1388(4) 0.5240(5) 0.1636(4) 0.0373(15) Uani 1 1 d . . . . .
N2 N 0.1290(5) 0.5233(5) 0.3618(3) 0.0388(16) Uani 1 1 d . . . . .
O1 O 0.2775(4) 0.8217(4) 0.1385(3) 0.0526(15) Uani 1 1 d . . . . .
O2 O -0.0081(3) 0.7735(4) 0.0633(3) 0.0386(12) Uani 1 1 d . . . . .
O3 O 0.1493(4) 0.7701(4) 0.2775(3) 0.0433(13) Uani 1 1 d . . . . .
O4 O -0.0751(3) 0.2739(4) 0.0736(2) 0.0395(13) Uani 1 1 d . . . . .
O5 O 0.0754(4) 0.2675(4) 0.2883(2) 0.0385(12) Uani 1 1 d . . . . .
O6 O 0.1845(4) 0.1266(4) 0.1489(3) 0.0500(15) Uani 1 1 d . . . . .
O7 O 0.4326(4) 0.1701(5) 0.1748(3) 0.0660(18) Uani 1 1 d . . . . .
O8 O 0.2397(5) 0.2001(5) -0.0409(3) 0.0638(18) Uani 1 1 d . . . . .
O9 O 0.4546(4) 0.4169(5) 0.0501(3) 0.0580(16) Uani 1 1 d . . . . .
O10 O 0.5013(4) 0.6832(5) 0.1634(3) 0.0556(16) Uani 1 1 d . . . . .
O11 O 0.3056(5) 0.6900(6) -0.0508(3) 0.0675(19) Uani 1 1 d . . . . .
O12 O 0.3079(4) 0.2798(5) 0.3323(3) 0.0536(16) Uani 1 1 d . . . . .
O13 O 0.5182(3) 0.4251(5) 0.2420(3) 0.0482(15) Uani 1 1 d . . . . .
O14 O 0.3588(4) 0.6662(6) 0.3319(3) 0.075(2) Uani 1 1 d . . . . .
Cu1 Cu -0.00928(6) 0.52961(8) 0.15610(5) 0.0334(2) Uani 1 1 d . . . . .
Cu2 Cu 0.14575(6) 0.50871(7) 0.26644(4) 0.0290(2) Uani 1 1 d . . . . .
Ru1 Ru 0.15134(4) 0.62136(4) 0.14907(3) 0.01967(14) Uani 1 1 d . . . . .
Ru2 Ru 0.11963(4) 0.36885(4) 0.15496(2) 0.01926(14) Uani 1 1 d . . . . .
Ru3 Ru 0.27944(4) 0.33697(5) 0.09845(3) 0.02328(15) Uani 1 1 d . . . . .
Ru4 Ru 0.30985(4) 0.57528(5) 0.09294(3) 0.02357(15) Uani 1 1 d . . . . .
Ru5 Ru 0.30462(4) 0.47024(5) 0.22427(3) 0.02183(14) Uani 1 1 d . . . . .
Te1 Te 0.13384(3) 0.48083(4) 0.03692(2) 0.02161(13) Uani 1 1 d . . . . .
Cl1 Cl 0.5562(10) 0.4461(14) 0.4428(5) 0.129(4) Uani 0.5 1 d D . P A -1
C1S C 0.4818(15) 0.406(2) 0.4912(13) 0.101(8) Uani 0.5 1 d D . P A -1
H1SA H 0.5169 0.3597 0.5330 0.121 Uiso 0.5 1 calc R . P A -1
H1SB H 0.4288 0.3597 0.4610 0.121 Uiso 0.5 1 calc R . P A -1
Cl2 Cl 0.437(2) 0.522(2) 0.5200(12) 0.304(14) Uani 0.5 1 d D . P A -1


_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 O1 1.155(8) . ?
C1 Ru1 2.036(7) . ?
C1 Ru4 2.172(7) . ?
C2 O2 1.143(7) . ?
C2 Ru1 1.888(7) . ?
C3 O3 1.140(7) . ?
C3 Cu2 2.433(7) . ?
C3 Ru1 1.896(7) . ?
C4 O4 1.145(7) . ?
C4 Ru2 1.890(7) . ?
C5 O5 1.145(7) . ?
C5 Cu2 2.438(7) . ?
C5 Ru2 1.900(7) . ?
C6 O6 1.154(8) . ?
C6 Ru2 2.012(7) . ?
C6 Ru3 2.198(7) . ?
C7 O7 1.112(9) . ?
C7 Ru3 1.913(8) . ?
C8 O8 1.135(8) . ?
C8 Ru3 1.906(7) . ?
C9 O9 1.147(8) . ?
C9 Ru3 2.117(7) . ?
C9 Ru4 2.114(7) . ?
C10 O10 1.135(8) . ?
C10 Ru4 1.875(7) . ?
C11 O11 1.136(8) . ?
C11 Ru4 1.920(7) . ?
C12 O12 1.150(8) . ?
C12 Ru5 1.897(7) . ?
C13 O13 1.136(8) . ?
C13 Ru5 1.914(7) . ?
C14 O14 1.138(8) . ?
C14 Ru5 1.918(8) . ?
C15 C16 1.466(11) . ?
C15 N1 1.114(9) . ?
C17 C18 1.453(11) . ?
C17 N2 1.119(9) . ?
N1 Cu1 1.910(6) . ?
N2 Cu2 1.915(6) . ?
Cu1 Cu2 2.6448(12) . ?
Cu1 Ru1 2.5882(10) . ?
Cu1 Ru2 2.6551(10) . ?
Cu2 Ru1 2.6321(9) . ?
Cu2 Ru2 2.6445(9) . ?
Cu2 Ru5 2.6604(10) . ?
Ru1 Ru2 3.0150(8) . ?
Ru1 Ru4 2.8235(7) . ?
Ru1 Ru5 2.9009(7) . ?
Ru1 Te1 2.6714(6) . ?
Ru2 Ru3 2.8177(7) . ?
Ru2 Ru5 2.8970(7) . ?
Ru2 Te1 2.6742(6) . ?
Ru3 Ru4 2.8465(8) . ?
Ru3 Ru5 2.8192(7) . ?
Ru3 Te1 2.7080(7) . ?
Ru4 Ru5 2.8247(7) . ?
Ru4 Te1 2.7123(7) . ?
Cl1 C1S 1.66(2) . ?
C1S Cl2 1.66(2) . ?

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
O1 C1 Ru1 140.4(6) . . ?
O1 C1 Ru4 135.4(6) . . ?
Ru1 C1 Ru4 84.2(3) . . ?
O2 C2 Ru1 174.6(6) . . ?
O3 C3 Cu2 114.5(5) . . ?
O3 C3 Ru1 171.8(6) . . ?
Ru1 C3 Cu2 73.7(2) . . ?
O4 C4 Ru2 176.1(6) . . ?
O5 C5 Cu2 113.7(5) . . ?
O5 C5 Ru2 172.3(6) . . ?
Ru2 C5 Cu2 74.0(2) . . ?
O6 C6 Ru2 142.8(6) . . ?
O6 C6 Ru3 133.3(6) . . ?
Ru2 C6 Ru3 83.9(3) . . ?
O7 C7 Ru3 177.4(8) . . ?
O8 C8 Ru3 178.1(7) . . ?
O9 C9 Ru3 137.0(6) . . ?
O9 C9 Ru4 138.4(6) . . ?
Ru4 C9 Ru3 84.6(3) . . ?
O10 C10 Ru4 176.7(7) . . ?
O11 C11 Ru4 177.9(7) . . ?
O12 C12 Ru5 175.8(6) . . ?
O13 C13 Ru5 175.6(6) . . ?
O14 C14 Ru5 176.6(7) . . ?
N1 C15 C16 177.0(9) . . ?
N2 C17 C18 179.4(12) . . ?
C15 N1 Cu1 172.3(7) . . ?
C17 N2 Cu2 169.4(7) . . ?
N1 Cu1 Cu2 124.7(2) . . ?
N1 Cu1 Ru1 157.29(17) . . ?
N1 Cu1 Ru2 132.43(17) . . ?
Cu2 Cu1 Ru2 59.86(3) . . ?
Ru1 Cu1 Cu2 60.38(3) . . ?
Ru1 Cu1 Ru2 70.19(3) . . ?
C3 Cu2 C5 152.5(2) . . ?
C3 Cu2 Cu1 76.91(15) . . ?
C3 Cu2 Ru1 43.74(16) . . ?
C3 Cu2 Ru2 112.97(16) . . ?
C3 Cu2 Ru5 89.75(16) . . ?
C5 Cu2 Cu1 77.44(15) . . ?
C5 Cu2 Ru1 112.55(15) . . ?
C5 Cu2 Ru2 43.68(15) . . ?
C5 Cu2 Ru5 90.92(16) . . ?
N2 Cu2 C3 100.9(2) . . ?
N2 Cu2 C5 99.7(2) . . ?
N2 Cu2 Cu1 117.4(2) . . ?
N2 Cu2 Ru1 144.25(18) . . ?
N2 Cu2 Ru2 143.21(19) . . ?
N2 Cu2 Ru5 130.0(2) . . ?
Cu1 Cu2 Ru5 112.52(4) . . ?
Ru1 Cu2 Cu1 58.74(3) . . ?
Ru1 Cu2 Ru2 69.69(3) . . ?
Ru1 Cu2 Ru5 66.47(2) . . ?
Ru2 Cu2 Cu1 60.26(3) . . ?
Ru2 Cu2 Ru5 66.20(2) . . ?
C1 Ru1 Cu1 165.0(2) . . ?
C1 Ru1 Cu2 129.79(19) . . ?
C1 Ru1 Ru2 137.4(2) . . ?
C1 Ru1 Ru4 49.9(2) . . ?
C1 Ru1 Ru5 88.1(2) . . ?
C1 Ru1 Te1 99.46(19) . . ?
C2 Ru1 C1 93.5(3) . . ?
C2 Ru1 C3 88.7(3) . . ?
C2 Ru1 Cu1 71.7(2) . . ?
C2 Ru1 Cu2 123.61(19) . . ?
C2 Ru1 Ru2 118.2(2) . . ?
C2 Ru1 Ru4 119.59(19) . . ?
C2 Ru1 Ru5 176.08(19) . . ?
C2 Ru1 Te1 91.05(19) . . ?
C3 Ru1 C1 88.9(3) . . ?
C3 Ru1 Cu1 88.3(2) . . ?
C3 Ru1 Cu2 62.5(2) . . ?
C3 Ru1 Ru2 117.3(2) . . ?
C3 Ru1 Ru4 127.9(2) . . ?
C3 Ru1 Ru5 94.86(19) . . ?
C3 Ru1 Te1 171.6(2) . . ?
Cu1 Ru1 Cu2 60.87(3) . . ?
Cu1 Ru1 Ru2 55.95(2) . . ?
Cu1 Ru1 Ru4 139.81(3) . . ?
Cu1 Ru1 Ru5 106.83(3) . . ?
Cu1 Ru1 Te1 83.68(3) . . ?
Cu2 Ru1 Ru2 55.35(2) . . ?
Cu2 Ru1 Ru4 116.20(3) . . ?
Cu2 Ru1 Ru5 57.23(2) . . ?
Cu2 Ru1 Te1 110.99(3) . . ?
Ru4 Ru1 Ru2 88.32(2) . . ?
Ru4 Ru1 Ru5 59.116(18) . . ?
Ru5 Ru1 Ru2 58.603(17) . . ?
Te1 Ru1 Ru2 55.711(16) . . ?
Te1 Ru1 Ru4 59.078(17) . . ?
Te1 Ru1 Ru5 85.17(2) . . ?
C4 Ru2 C5 87.8(3) . . ?
C4 Ru2 C6 92.9(3) . . ?
C4 Ru2 Cu1 72.1(2) . . ?
C4 Ru2 Cu2 123.0(2) . . ?
C4 Ru2 Ru1 116.7(2) . . ?
C4 Ru2 Ru3 120.0(2) . . ?
C4 Ru2 Ru5 174.89(19) . . ?
C4 Ru2 Te1 90.15(19) . . ?
C5 Ru2 C6 91.5(3) . . ?
C5 Ru2 Cu1 87.0(2) . . ?
C5 Ru2 Cu2 62.37(19) . . ?
C5 Ru2 Ru1 116.38(19) . . ?
C5 Ru2 Ru3 130.6(2) . . ?
C5 Ru2 Ru5 96.38(19) . . ?
C5 Ru2 Te1 169.3(2) . . ?
C6 Ru2 Cu1 164.9(2) . . ?
C6 Ru2 Cu2 131.8(2) . . ?
C6 Ru2 Ru1 138.6(2) . . ?
C6 Ru2 Ru3 50.9(2) . . ?
C6 Ru2 Ru5 90.0(2) . . ?
C6 Ru2 Te1 99.16(19) . . ?
Cu1 Ru2 Ru1 53.86(2) . . ?
Cu1 Ru2 Ru3 137.93(3) . . ?
Cu1 Ru2 Ru5 105.15(3) . . ?
Cu1 Ru2 Te1 82.36(3) . . ?
Cu2 Ru2 Cu1 59.87(3) . . ?
Cu2 Ru2 Ru1 54.96(2) . . ?
Cu2 Ru2 Ru3 116.07(3) . . ?
Cu2 Ru2 Ru5 57.16(2) . . ?
Cu2 Ru2 Te1 110.52(3) . . ?
Ru3 Ru2 Ru1 88.26(2) . . ?
Ru3 Ru2 Ru5 59.098(18) . . ?
Ru5 Ru2 Ru1 58.730(17) . . ?
Te1 Ru2 Ru1 55.622(16) . . ?
Te1 Ru2 Ru3 59.019(17) . . ?
Te1 Ru2 Ru5 85.196(19) . . ?
C6 Ru3 Ru2 45.24(19) . . ?
C6 Ru3 Ru4 136.67(18) . . ?
C6 Ru3 Ru5 88.40(18) . . ?
C6 Ru3 Te1 93.61(19) . . ?
C7 Ru3 C6 82.7(3) . . ?
C7 Ru3 C9 89.1(3) . . ?
C7 Ru3 Ru2 117.8(2) . . ?
C7 Ru3 Ru4 123.1(2) . . ?
C7 Ru3 Ru5 91.3(2) . . ?
C7 Ru3 Te1 175.6(2) . . ?
C8 Ru3 C6 91.3(3) . . ?
C8 Ru3 C7 92.6(3) . . ?
C8 Ru3 C9 91.2(3) . . ?
C8 Ru3 Ru2 115.4(2) . . ?
C8 Ru3 Ru4 118.3(2) . . ?
C8 Ru3 Ru5 175.9(2) . . ?
C8 Ru3 Te1 89.9(2) . . ?
C9 Ru3 C6 171.6(3) . . ?
C9 Ru3 Ru2 139.44(19) . . ?
C9 Ru3 Ru4 47.67(19) . . ?
C9 Ru3 Ru5 89.70(19) . . ?
C9 Ru3 Te1 94.4(2) . . ?
Ru2 Ru3 Ru4 91.86(2) . . ?
Ru2 Ru3 Ru5 61.852(18) . . ?
Ru5 Ru3 Ru4 59.808(18) . . ?
Te1 Ru3 Ru2 57.848(17) . . ?
Te1 Ru3 Ru4 58.395(17) . . ?
Te1 Ru3 Ru5 86.11(2) . . ?
C1 Ru4 Ru1 45.84(18) . . ?
C1 Ru4 Ru3 136.64(19) . . ?
C1 Ru4 Ru5 87.55(19) . . ?
C1 Ru4 Te1 94.85(18) . . ?
C9 Ru4 C1 170.1(3) . . ?
C9 Ru4 Ru1 139.3(2) . . ?
C9 Ru4 Ru3 47.77(19) . . ?
C9 Ru4 Ru5 89.62(19) . . ?
C9 Ru4 Te1 94.4(2) . . ?
C10 Ru4 C1 83.0(3) . . ?
C10 Ru4 C9 87.6(3) . . ?
C10 Ru4 C11 92.8(3) . . ?
C10 Ru4 Ru1 118.6(2) . . ?
C10 Ru4 Ru3 121.2(2) . . ?
C10 Ru4 Ru5 90.2(2) . . ?
C10 Ru4 Te1 175.6(2) . . ?
C11 Ru4 C1 91.5(3) . . ?
C11 Ru4 C9 91.8(3) . . ?
C11 Ru4 Ru1 115.5(2) . . ?
C11 Ru4 Ru3 119.6(2) . . ?
C11 Ru4 Ru5 176.8(2) . . ?
C11 Ru4 Te1 91.1(2) . . ?
Ru1 Ru4 Ru3 91.56(2) . . ?
Ru1 Ru4 Ru5 61.808(18) . . ?
Ru5 Ru4 Ru3 59.616(18) . . ?
Te1 Ru4 Ru1 57.665(17) . . ?
Te1 Ru4 Ru3 58.249(17) . . ?
Te1 Ru4 Ru5 85.924(19) . . ?
C12 Ru5 C13 90.6(3) . . ?
C12 Ru5 C14 97.6(3) . . ?
C12 Ru5 Cu2 75.6(2) . . ?
C12 Ru5 Ru1 130.0(2) . . ?
C12 Ru5 Ru2 81.0(2) . . ?
C12 Ru5 Ru3 99.4(2) . . ?
C12 Ru5 Ru4 159.6(2) . . ?
C13 Ru5 C14 91.3(3) . . ?
C13 Ru5 Cu2 158.4(2) . . ?
C13 Ru5 Ru1 139.3(2) . . ?
C13 Ru5 Ru2 138.5(2) . . ?
C13 Ru5 Ru3 82.8(2) . . ?
C13 Ru5 Ru4 83.3(2) . . ?
C14 Ru5 Cu2 74.4(2) . . ?
C14 Ru5 Ru1 83.0(2) . . ?
C14 Ru5 Ru2 130.0(2) . . ?
C14 Ru5 Ru3 162.1(3) . . ?
C14 Ru5 Ru4 102.1(3) . . ?
Cu2 Ru5 Ru1 56.30(2) . . ?
Cu2 Ru5 Ru2 56.64(2) . . ?
Cu2 Ru5 Ru3 115.50(3) . . ?
Cu2 Ru5 Ru4 115.23(3) . . ?
Ru2 Ru5 Ru1 62.667(18) . . ?
Ru3 Ru5 Ru1 90.53(2) . . ?
Ru3 Ru5 Ru2 59.050(18) . . ?
Ru3 Ru5 Ru4 60.576(19) . . ?
Ru4 Ru5 Ru1 59.076(18) . . ?
Ru4 Ru5 Ru2 90.67(2) . . ?
Ru1 Te1 Ru2 68.667(19) . . ?
Ru1 Te1 Ru3 98.12(2) . . ?
Ru1 Te1 Ru4 63.257(18) . . ?
Ru2 Te1 Ru3 63.134(18) . . ?
Ru2 Te1 Ru4 98.141(19) . . ?
Ru3 Te1 Ru4 63.356(19) . . ?
Cl1 C1S Cl2 108(2) . . ?

_shelx_SHELXL_version_number     2014/7

