#------------------------------------------------------------------------------
#$Date: 2016-03-26 14:37:05 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180270 $
#$URL: svn://www.crystallography.net/cod/cif/7/11/56/7115633.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7115633
loop_
_publ_author_name
'Alexander J. Metherell'
'Michael D. Ward'
_publ_section_title
;
 Stepwise assembly of an adamantoid Ru4Ag6 cage by control of metal
 coordination geometry at specific sites
;
_journal_name_full               Chem.Commun.
_journal_page_first              10979
_journal_paper_doi               10.1039/C4cc05421K
_journal_volume                  50
_journal_year                    2014
_chemical_formula_moiety         'C288 H240 Ag6 N72 Ru4, 14(F6 P)'
_chemical_formula_sum            'C288 H240 Ag6 F84 N72 P14 Ru4'
_chemical_formula_weight         7790.59
_chemical_name_systematic
;
 ?
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           13
_space_group_name_Hall           '-P 2yac'
_space_group_name_H-M_alt        'P 1 2/n 1'
_symmetry_space_group_name_Hall  '-P 2yac'
_symmetry_space_group_name_H-M   'P 1 2/n 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                90
_cell_angle_beta                 102.819(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   24.688(3)
_cell_length_b                   30.324(4)
_cell_length_c                   25.247(3)
_cell_measurement_reflns_used    32500
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      25.0
_cell_measurement_theta_min      2.3
_cell_volume                     18430(4)
_computing_cell_refinement
;
CrystalClear-SM Expert 2.1 b29 (Rigaku, 2013)
;
_computing_data_collection
;
CrystalClear-SM Expert 2.1 b29 (Rigaku, 2013)
;
_computing_data_reduction
;
CrystalClear-SM Expert 2.1 b29 (Rigaku, 2013)
;
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick 2013)'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_diffrn_ambient_temperature      100
_diffrn_detector                 CCD
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.721
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device
;
AFC12 (Right): Kappa 3 circle
;
_diffrn_measurement_device_type
;
Rigaku Saturn724+ (2x2 bin mode)
;
_diffrn_measurement_method       'profile data from ω-scans'
_diffrn_measurement_specimen_support Mitegen
_diffrn_radiation_monochromator  Confocal
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0646
_diffrn_reflns_av_unetI/netI     0.0348
_diffrn_reflns_Laue_measured_fraction_full 0.721
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       32
_diffrn_reflns_limit_k_min       -32
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            167655
_diffrn_reflns_point_group_measured_fraction_full 0.721
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         22.500
_diffrn_reflns_theta_min         2.269
_diffrn_source                   'Rotating Anode'
_diffrn_source_current           55.0
_diffrn_source_power             2.5
_diffrn_source_voltage           45.0
_exptl_absorpt_coefficient_mu    0.630
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.718
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.404
_exptl_crystal_description       Block
_exptl_crystal_F_000             7792
_exptl_crystal_size_max          0.180
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.050
_refine_diff_density_max         1.559
_refine_diff_density_min         -1.081
_refine_diff_density_rms         0.150
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.618
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1560
_refine_ls_number_reflns         24082
_refine_ls_number_restraints     1746
_refine_ls_restrained_S_all      1.578
_refine_ls_R_factor_all          0.1658
_refine_ls_R_factor_gt           0.1405
_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)+(0.2000P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.4104
_refine_ls_wR_factor_ref         0.4293
_reflns_Friedel_coverage         0.000
_reflns_number_gt                15979
_reflns_number_total             24082
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c4cc05421k2.cif
_cod_data_source_block           p2n_sqd
_cod_database_code               7115633
#BEGIN Tags that were not found in dictionaries:
_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.
;
_shelx_estimated_absorpt_t_min   0.895
_shelx_estimated_absorpt_t_max   0.969
_shelxl_version_number           2013-4
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y, -z+1/2'
'-x, -y, -z'
'x-1/2, -y, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
Ru1 Ru 0.01158(4) 0.39023(3) 0.23682(4) 0.0907(4) Uani 1 1 d . . .
Ru2 Ru 0.25670(4) 0.10785(4) 0.49407(5) 0.1056(4) Uani 1 1 d . . .
Ag1 Ag -0.04020(6) 0.25644(6) 0.53558(6) 0.1554(6) Uani 1 1 d . . .
Ag2 Ag 0.2500 -0.11542(5) 0.2500 0.1225(6) Uani 1 2 d S T P
Ag3 Ag 0.2500 0.61465(5) 0.2500 0.1331(6) Uani 1 2 d S T P
Ag4 Ag 0.60023(6) 0.24823(3) 0.59156(6) 0.1314(5) Uani 1 1 d . . .
N11A N 0.0123(3) 0.4565(3) 0.2168(4) 0.1230(14) Uani 1 1 d G U .
C12A C 0.0276(4) 0.4651(3) 0.1681(3) 0.1235(13) Uani 1 1 d G U .
C13A C 0.0293(4) 0.5083(4) 0.1501(3) 0.1243(14) Uani 1 1 d G U .
H13A H 0.0398 0.5142 0.1168 0.149 Uiso 1 1 calc R U .
C14A C 0.0157(4) 0.5429(3) 0.1809(4) 0.1246(15) Uani 1 1 d G U .
H14A H 0.0169 0.5724 0.1686 0.150 Uiso 1 1 calc R U .
C15A C 0.0004(4) 0.5343(3) 0.2296(4) 0.1245(15) Uani 1 1 d G U .
H15A H -0.0088 0.5579 0.2507 0.149 Uiso 1 1 calc R U .
C16A C -0.0013(3) 0.4911(3) 0.2476(3) 0.1237(15) Uani 1 1 d G U .
H16A H -0.0117 0.4852 0.2809 0.148 Uiso 1 1 calc R U .
N21A N 0.0676(4) 0.3579(3) 0.1360(4) 0.1249(13) Uani 1 1 d G U .
N22A N 0.0465(4) 0.3890(3) 0.1684(3) 0.1236(13) Uani 1 1 d G U .
C23A C 0.0414(4) 0.4302(3) 0.1410(4) 0.1238(13) Uani 1 1 d G U .
C24A C 0.0594(4) 0.4246(3) 0.0917(4) 0.1246(14) Uani 1 1 d G U .
H24A H 0.0604 0.4468 0.0655 0.149 Uiso 1 1 calc R U .
C25A C 0.0755(4) 0.3799(4) 0.0887(3) 0.1249(14) Uani 1 1 d G U .
H25A H 0.0893 0.3669 0.0600 0.150 Uiso 1 1 calc R U .
C26A C 0.0717(6) 0.3147(5) 0.1519(6) 0.1258(14) Uani 1 1 d . U .
H26A H 0.0710 0.3130 0.1909 0.151 Uiso 1 1 calc R U .
H26B H 0.1079 0.3030 0.1477 0.151 Uiso 1 1 calc R U .
C31A C 0.0280(4) 0.2871(3) 0.1216(4) 0.1269(14) Uani 1 1 d G U .
C32A C -0.0201(4) 0.3030(3) 0.0874(4) 0.1275(15) Uani 1 1 d G U .
H32A H -0.0242 0.3338 0.0802 0.153 Uiso 1 1 calc R U .
C33A C -0.0621(3) 0.2740(3) 0.0637(4) 0.1278(16) Uani 1 1 d G U .
H33A H -0.0950 0.2849 0.0404 0.153 Uiso 1 1 calc R U .
C34A C -0.0561(4) 0.2291(3) 0.0743(4) 0.1277(16) Uani 1 1 d G U .
C35A C -0.0080(4) 0.2132(3) 0.1085(4) 0.1278(16) Uani 1 1 d G U .
H35A H -0.0039 0.1825 0.1157 0.153 Uiso 1 1 calc R U .
C36A C 0.0340(3) 0.2422(3) 0.1321(4) 0.1276(15) Uani 1 1 d G U .
H36A H 0.0669 0.2313 0.1555 0.153 Uiso 1 1 calc R U .
N41A N 0.5795(4) 0.1947(2) 0.6490(4) 0.1195(14) Uani 1 1 d G U .
C42A C 0.5568(4) 0.1561(3) 0.6238(3) 0.1196(13) Uani 1 1 d G U .
C43A C 0.5331(4) 0.1253(2) 0.6526(4) 0.1197(14) Uani 1 1 d G U .
H43A H 0.5175 0.0989 0.6353 0.144 Uiso 1 1 calc R U .
C44A C 0.5321(4) 0.1331(3) 0.7066(4) 0.1198(15) Uani 1 1 d G U .
H44A H 0.5159 0.1121 0.7263 0.144 Uiso 1 1 calc R U .
C45A C 0.5548(4) 0.1717(3) 0.7318(3) 0.1199(15) Uani 1 1 d G U .
H45A H 0.5541 0.1771 0.7687 0.144 Uiso 1 1 calc R U .
C46A C 0.5785(4) 0.2025(2) 0.7030(4) 0.1199(15) Uani 1 1 d G U .
H46A H 0.5941 0.2289 0.7203 0.144 Uiso 1 1 calc R U .
N51A N 0.5864(4) 0.1691(3) 0.4890(3) 0.1221(14) Uani 1 1 d G U .
N52A N 0.5838(4) 0.1843(2) 0.5416(4) 0.1211(14) Uani 1 1 d G U .
C53A C 0.5621(4) 0.1497(3) 0.5686(3) 0.1207(13) Uani 1 1 d G U .
C54A C 0.5513(4) 0.1131(2) 0.5328(4) 0.1216(14) Uani 1 1 d G U .
H54A H 0.5366 0.0854 0.5404 0.146 Uiso 1 1 calc R U .
C55A C 0.5663(4) 0.1251(3) 0.4836(4) 0.1223(14) Uani 1 1 d G U .
H55A H 0.5634 0.1068 0.4525 0.147 Uiso 1 1 calc R U .
C56A C 0.6018(6) 0.1946(5) 0.4531(7) 0.1225(16) Uani 1 1 d . U .
H56A H 0.6114 0.1759 0.4244 0.147 Uiso 1 1 calc R U .
H56B H 0.6358 0.2108 0.4711 0.147 Uiso 1 1 calc R U .
N11B N -0.0227(3) 0.4004(3) 0.3046(3) 0.1057(12) Uani 1 1 d G U .
C12B C 0.0139(2) 0.4162(3) 0.3507(3) 0.1055(11) Uani 1 1 d G U .
C13B C -0.0055(3) 0.4272(3) 0.3966(3) 0.1069(12) Uani 1 1 d G U .
H13B H 0.0195 0.4381 0.4281 0.128 Uiso 1 1 calc R U .
C14B C -0.0616(3) 0.4223(3) 0.3965(3) 0.1077(13) Uani 1 1 d G U .
H14B H -0.0748 0.4298 0.4279 0.129 Uiso 1 1 calc R U .
C15B C -0.0981(2) 0.4065(3) 0.3505(3) 0.1076(13) Uani 1 1 d G U .
H15B H -0.1364 0.4031 0.3504 0.129 Uiso 1 1 calc R U .
C16B C -0.0787(3) 0.3955(3) 0.3045(3) 0.1066(13) Uani 1 1 d G U .
H16B H -0.1037 0.3847 0.2731 0.128 Uiso 1 1 calc R U .
N21B N 0.0794(3) 0.4030(3) 0.2984(3) 0.1024(11) Uani 1 1 d G U .
N22B N 0.1380(3) 0.4041(3) 0.3047(3) 0.1021(10) Uani 1 1 d G U .
C23B C 0.1616(2) 0.4200(3) 0.3577(3) 0.1027(11) Uani 1 1 d G U .
H23B H 0.2001 0.4241 0.3728 0.123 Uiso 1 1 calc R U .
C24B C 0.1176(3) 0.4288(3) 0.3841(3) 0.1033(11) Uani 1 1 d G U .
H24B H 0.1215 0.4398 0.4200 0.124 Uiso 1 1 calc R U .
C25B C 0.0668(2) 0.4183(3) 0.3474(3) 0.1036(10) Uani 1 1 d G U .
C26B C 0.1659(5) 0.3941(4) 0.2627(5) 0.1019(10) Uani 1 1 d . U .
H26C H 0.1454 0.3704 0.2396 0.122 Uiso 1 1 calc R U .
H26D H 0.2035 0.3829 0.2791 0.122 Uiso 1 1 calc R U .
C31B C 0.1707(3) 0.4342(2) 0.2273(3) 0.1029(10) Uani 1 1 d G U .
C32B C 0.1643(3) 0.4771(3) 0.2441(3) 0.1036(11) Uani 1 1 d G U .
H32B H 0.1551 0.4824 0.2782 0.124 Uiso 1 1 calc R U .
C33B C 0.1714(3) 0.5124(2) 0.2111(3) 0.1048(11) Uani 1 1 d G U .
H33B H 0.1670 0.5418 0.2226 0.126 Uiso 1 1 calc R U .
C34B C 0.1848(3) 0.5047(2) 0.1613(3) 0.1056(11) Uani 1 1 d G U .
C35B C 0.1912(3) 0.4618(3) 0.1445(3) 0.1046(11) Uani 1 1 d G U .
H35B H 0.2004 0.4565 0.1104 0.126 Uiso 1 1 calc R U .
C36B C 0.1842(3) 0.4265(2) 0.1775(3) 0.1035(11) Uani 1 1 d G U .
H36B H 0.1886 0.3971 0.1659 0.124 Uiso 1 1 calc R U .
N41B N 0.3421(3) 0.6301(3) 0.2507(4) 0.1169(13) Uani 1 1 d G U .
C42B C 0.3645(3) 0.6122(3) 0.2097(3) 0.1159(12) Uani 1 1 d G U .
C43B C 0.4187(3) 0.6223(3) 0.2068(3) 0.1173(13) Uani 1 1 d G U .
H43B H 0.4341 0.6100 0.1788 0.141 Uiso 1 1 calc R U .
C44B C 0.4505(3) 0.6503(3) 0.2450(4) 0.1184(14) Uani 1 1 d G U .
H44B H 0.4875 0.6572 0.2431 0.142 Uiso 1 1 calc R U .
C45B C 0.4280(3) 0.6683(3) 0.2861(3) 0.1186(14) Uani 1 1 d G U .
H45B H 0.4497 0.6874 0.3122 0.142 Uiso 1 1 calc R U .
C46B C 0.3738(3) 0.6582(3) 0.2889(3) 0.1180(14) Uani 1 1 d G U .
H46B H 0.3585 0.6704 0.3170 0.142 Uiso 1 1 calc R U .
N51B N 0.2478(2) 0.5535(3) 0.1321(3) 0.1104(11) Uani 1 1 d G U .
N52B N 0.2735(3) 0.5827(3) 0.1742(3) 0.1119(11) Uani 1 1 d G U .
C53B C 0.3304(3) 0.5865(3) 0.1727(3) 0.1131(11) Uani 1 1 d G U .
C54B C 0.3400(3) 0.5596(3) 0.1296(4) 0.1123(12) Uani 1 1 d G U .
H54B H 0.3745 0.5559 0.1194 0.135 Uiso 1 1 calc R U .
C55B C 0.2890(3) 0.5393(3) 0.1045(3) 0.1112(12) Uani 1 1 d G U .
H55B H 0.2834 0.5196 0.0745 0.133 Uiso 1 1 calc R U .
C56B C 0.1915(5) 0.5432(5) 0.1236(5) 0.1084(11) Uani 1 1 d . U .
H56C H 0.1769 0.5347 0.0852 0.130 Uiso 1 1 calc R U .
H56D H 0.1704 0.5691 0.1317 0.130 Uiso 1 1 calc R U .
N11C N -0.0655(3) 0.3787(3) 0.1848(3) 0.1157(13) Uani 1 1 d G U .
C12C C -0.0866(3) 0.3362(3) 0.1856(3) 0.1156(12) Uani 1 1 d G U .
C13C C -0.1374(3) 0.3254(2) 0.1519(4) 0.1163(14) Uani 1 1 d G U .
H13C H -0.1518 0.2964 0.1524 0.140 Uiso 1 1 calc R U .
C14C C -0.1671(3) 0.3571(3) 0.1175(3) 0.1170(14) Uani 1 1 d G U .
H14C H -0.2019 0.3497 0.0945 0.140 Uiso 1 1 calc R U .
C15C C -0.1460(3) 0.3995(3) 0.1167(3) 0.1169(14) Uani 1 1 d G U .
H15C H -0.1664 0.4211 0.0932 0.140 Uiso 1 1 calc R U .
C16C C -0.0952(3) 0.4103(2) 0.1504(3) 0.1164(14) Uani 1 1 d G U .
H16C H -0.0808 0.4393 0.1499 0.140 Uiso 1 1 calc R U .
N21C N 0.0302(3) 0.2873(3) 0.2735(3) 0.1151(12) Uani 1 1 d G U .
N22C N 0.0004(3) 0.3236(2) 0.2458(3) 0.1149(12) Uani 1 1 d G U .
C23C C -0.0528(3) 0.3084(3) 0.2183(4) 0.1150(12) Uani 1 1 d G U .
C24C C -0.0559(3) 0.2626(3) 0.2290(4) 0.1152(13) Uani 1 1 d G U .
H24C H -0.0868 0.2439 0.2157 0.138 Uiso 1 1 calc R U .
C25C C -0.0046(4) 0.2495(2) 0.2631(4) 0.1153(13) Uani 1 1 d G U .
H25C H 0.0048 0.2206 0.2766 0.138 Uiso 1 1 calc R U .
C26C C 0.0804(5) 0.2932(5) 0.3113(5) 0.1153(12) Uani 1 1 d . U .
H26E H 0.1019 0.3164 0.2974 0.138 Uiso 1 1 calc R U .
H26F H 0.1020 0.2655 0.3134 0.138 Uiso 1 1 calc R U .
C31C C 0.0759(3) 0.3056(3) 0.3675(3) 0.1165(12) Uani 1 1 d G U .
C32C C 0.0272(3) 0.3028(3) 0.3863(3) 0.1175(12) Uani 1 1 d G U .
H32C H -0.0060 0.2924 0.3630 0.141 Uiso 1 1 calc R U .
C33C C 0.0270(3) 0.3152(4) 0.4393(3) 0.1188(12) Uani 1 1 d G U .
H33C H -0.0063 0.3132 0.4522 0.143 Uiso 1 1 calc R U .
C34C C 0.0755(4) 0.3304(4) 0.4734(3) 0.1200(12) Uani 1 1 d G U .
C35C C 0.1242(3) 0.3332(3) 0.4546(3) 0.1185(12) Uani 1 1 d G U .
H35C H 0.1574 0.3435 0.4779 0.142 Uiso 1 1 calc R U .
C36C C 0.1244(3) 0.3208(3) 0.4016(3) 0.1172(12) Uani 1 1 d G U .
H36C H 0.1577 0.3227 0.3888 0.141 Uiso 1 1 calc R U .
N41C N -0.0018(4) 0.2030(3) 0.5991(3) 0.1289(14) Uani 1 1 d G U .
C42C C 0.0534(4) 0.2086(3) 0.6258(4) 0.1284(13) Uani 1 1 d G U .
C43C C 0.0782(3) 0.1789(4) 0.6658(4) 0.1291(14) Uani 1 1 d G U .
H43C H 0.1159 0.1827 0.6841 0.155 Uiso 1 1 calc R U .
C44C C 0.0478(4) 0.1436(3) 0.6791(3) 0.1297(15) Uani 1 1 d G U .
H44C H 0.0647 0.1233 0.7065 0.156 Uiso 1 1 calc R U .
C45C C -0.0074(4) 0.1381(3) 0.6524(4) 0.1297(15) Uani 1 1 d G U .
H45C H -0.0282 0.1140 0.6615 0.156 Uiso 1 1 calc R U .
C46C C -0.0322(3) 0.1678(3) 0.6124(4) 0.1295(15) Uani 1 1 d G U .
H46C H -0.0699 0.1640 0.5941 0.155 Uiso 1 1 calc R U .
N51C N 0.0904(4) 0.3085(3) 0.5679(3) 0.1250(12) Uani 1 1 d G U .
N52C N 0.0512(3) 0.2760(3) 0.5749(4) 0.1260(13) Uani 1 1 d G U .
C53C C 0.0801(4) 0.2426(3) 0.6094(4) 0.1271(12) Uani 1 1 d G U .
C54C C 0.1371(4) 0.2545(3) 0.6237(4) 0.1266(13) Uani 1 1 d G U .
H54C H 0.1659 0.2381 0.6464 0.152 Uiso 1 1 calc R U .
C55C C 0.1435(3) 0.2952(3) 0.5981(4) 0.1259(13) Uani 1 1 d G U .
H55C H 0.1773 0.3109 0.6006 0.151 Uiso 1 1 calc R U .
C56C C 0.0737(6) 0.3445(5) 0.5329(5) 0.1231(12) Uani 1 1 d . U .
H56E H 0.0988 0.3698 0.5443 0.148 Uiso 1 1 calc R U .
H56F H 0.0355 0.3535 0.5344 0.148 Uiso 1 1 calc R U .
N11D N 0.3126(3) 0.1215(3) 0.5676(3) 0.1162(13) Uani 1 1 d G U .
C12D C 0.3143(3) 0.1649(3) 0.5855(3) 0.1161(12) Uani 1 1 d G U .
C13D C 0.3496(3) 0.1768(2) 0.6343(4) 0.1167(14) Uani 1 1 d G U .
H13D H 0.3507 0.2065 0.6465 0.140 Uiso 1 1 calc R U .
C14D C 0.3834(3) 0.1452(3) 0.6652(3) 0.1177(14) Uani 1 1 d G U .
H14D H 0.4076 0.1533 0.6985 0.141 Uiso 1 1 calc R U .
C15D C 0.3818(3) 0.1018(3) 0.6473(3) 0.1179(14) Uani 1 1 d G U .
H15D H 0.4048 0.0802 0.6684 0.141 Uiso 1 1 calc R U .
C16D C 0.3464(3) 0.0899(2) 0.5985(4) 0.1171(14) Uani 1 1 d G U .
H16D H 0.3453 0.0602 0.5863 0.141 Uiso 1 1 calc R U .
N21D N 0.2215(3) 0.2103(3) 0.4709(3) 0.1155(11) Uani 1 1 d G U .
N22D N 0.2507(3) 0.1749(2) 0.5014(3) 0.1150(12) Uani 1 1 d G U .
C23D C 0.2797(3) 0.1919(3) 0.5522(3) 0.1152(12) Uani 1 1 d G U .
C24D C 0.2683(4) 0.2378(3) 0.5532(3) 0.1152(13) Uani 1 1 d G U .
H24D H 0.2824 0.2574 0.5823 0.138 Uiso 1 1 calc R U .
C25D C 0.2324(4) 0.2492(2) 0.5030(4) 0.1154(13) Uani 1 1 d G U .
H25D H 0.2181 0.2777 0.4926 0.138 Uiso 1 1 calc R U .
C26D C 0.1846(5) 0.2044(5) 0.4206(6) 0.1162(12) Uani 1 1 d . U .
H26G H 0.1986 0.1803 0.4008 0.139 Uiso 1 1 calc R U .
H26H H 0.1838 0.2317 0.3989 0.139 Uiso 1 1 calc R U .
C31D C 0.1251(2) 0.1934(3) 0.4254(4) 0.1171(11) Uani 1 1 d G U .
C32D C 0.0881(3) 0.1796(3) 0.3785(3) 0.1176(12) Uani 1 1 d G U .
H32D H 0.1003 0.1763 0.3456 0.141 Uiso 1 1 calc R U .
C33D C 0.0331(3) 0.1706(3) 0.3797(3) 0.1183(12) Uani 1 1 d G U .
H33D H 0.0078 0.1612 0.3476 0.142 Uiso 1 1 calc R U .
C34D C 0.0152(2) 0.1754(3) 0.4278(4) 0.1191(12) Uani 1 1 d G U .
C35D C 0.0522(3) 0.1892(3) 0.4748(3) 0.1186(12) Uani 1 1 d G U .
H35D H 0.0400 0.1924 0.5076 0.142 Uiso 1 1 calc R U .
C36D C 0.1071(3) 0.1981(3) 0.4736(3) 0.1177(12) Uani 1 1 d G U .
H36D H 0.1324 0.2075 0.5056 0.141 Uiso 1 1 calc R U .
N41D N -0.1000(3) 0.3145(3) 0.4985(4) 0.1211(14) Uani 1 1 d G U .
C42D C -0.1285(4) 0.3092(3) 0.4448(4) 0.1208(13) Uani 1 1 d G U .
C43D C -0.1659(3) 0.3412(3) 0.4200(3) 0.1212(14) Uani 1 1 d G U .
H43D H -0.1854 0.3376 0.3834 0.145 Uiso 1 1 calc R U .
C44D C -0.1747(3) 0.3786(3) 0.4488(4) 0.1217(14) Uani 1 1 d G U .
H44D H -0.2002 0.4006 0.4319 0.146 Uiso 1 1 calc R U .
C45D C -0.1461(4) 0.3840(3) 0.5025(4) 0.1214(14) Uani 1 1 d G U .
H45D H -0.1521 0.4095 0.5221 0.146 Uiso 1 1 calc R U .
C46D C -0.1088(3) 0.3519(3) 0.5273(3) 0.1215(14) Uani 1 1 d G U .
H46D H -0.0893 0.3555 0.5639 0.146 Uiso 1 1 calc R U .
N51D N -0.0782(3) 0.2047(3) 0.4109(4) 0.1201(12) Uani 1 1 d G U .
N52D N -0.0836(3) 0.2383(3) 0.4485(3) 0.1203(12) Uani 1 1 d G U .
C53D C -0.1152(4) 0.2732(3) 0.4193(4) 0.1203(12) Uani 1 1 d G U .
C54D C -0.1293(4) 0.2611(3) 0.3636(4) 0.1204(13) Uani 1 1 d G U .
H54D H -0.1504 0.2783 0.3348 0.144 Uiso 1 1 calc R U .
C55D C -0.1065(4) 0.2187(3) 0.3584(3) 0.1203(13) Uani 1 1 d G U .
H55D H -0.1096 0.2026 0.3256 0.144 Uiso 1 1 calc R U .
C56D C -0.0471(5) 0.1691(5) 0.4297(6) 0.1205(12) Uani 1 1 d . U .
H56G H -0.0621 0.1430 0.4077 0.145 Uiso 1 1 calc R U .
H56H H -0.0497 0.1633 0.4677 0.145 Uiso 1 1 calc R U .
N11E N 0.2741(3) 0.0393(2) 0.4967(4) 0.1253(13) Uani 1 1 d G U .
C12E C 0.3218(3) 0.0262(3) 0.4803(4) 0.1247(13) Uani 1 1 d G U .
C13E C 0.3363(3) -0.0181(3) 0.4816(4) 0.1259(14) Uani 1 1 d G U .
H13E H 0.3689 -0.0270 0.4704 0.151 Uiso 1 1 calc R U .
C14E C 0.3032(4) -0.0494(2) 0.4994(4) 0.1268(14) Uani 1 1 d G U .
H14E H 0.3132 -0.0796 0.5004 0.152 Uiso 1 1 calc R U .
C15E C 0.2556(3) -0.0363(3) 0.5159(4) 0.1269(14) Uani 1 1 d G U .
H15E H 0.2329 -0.0576 0.5281 0.152 Uiso 1 1 calc R U .
C16E C 0.2410(3) 0.0081(3) 0.5145(4) 0.1261(14) Uani 1 1 d G U .
H16E H 0.2084 0.0170 0.5258 0.151 Uiso 1 1 calc R U .
N21E N 0.3562(3) 0.1317(2) 0.4338(4) 0.1217(12) Uani 1 1 d G U .
N22E N 0.3231(3) 0.1030(3) 0.4579(4) 0.1216(12) Uani 1 1 d G U .
C23E C 0.3489(4) 0.0609(3) 0.4638(4) 0.1233(12) Uani 1 1 d G U .
C24E C 0.3980(3) 0.0636(3) 0.4434(5) 0.1235(13) Uani 1 1 d G U .
H24E H 0.4234 0.0402 0.4424 0.148 Uiso 1 1 calc R U .
C25E C 0.4025(3) 0.1073(3) 0.4248(4) 0.1228(13) Uani 1 1 d G U .
H25E H 0.4314 0.1184 0.4092 0.147 Uiso 1 1 calc R U .
C26E C 0.3444(6) 0.1739(5) 0.4252(6) 0.1203(12) Uani 1 1 d . U .
H26I H 0.3040 0.1776 0.4221 0.144 Uiso 1 1 calc R U .
H26J H 0.3521 0.1819 0.3895 0.144 Uiso 1 1 calc R U .
C31E C 0.3755(4) 0.2081(3) 0.4685(3) 0.1182(12) Uani 1 1 d G U .
C32E C 0.3638(3) 0.2529(3) 0.4640(3) 0.1175(12) Uani 1 1 d G U .
H32E H 0.3387 0.2640 0.4327 0.141 Uiso 1 1 calc R U .
C33E C 0.3887(4) 0.2816(2) 0.5052(4) 0.1160(12) Uani 1 1 d G U .
H33E H 0.3807 0.3122 0.5021 0.139 Uiso 1 1 calc R U .
C34E C 0.4254(4) 0.2654(3) 0.5509(3) 0.1144(11) Uani 1 1 d G U .
C35E C 0.4372(3) 0.2206(3) 0.5555(3) 0.1157(12) Uani 1 1 d G U .
H35E H 0.4622 0.2095 0.5868 0.139 Uiso 1 1 calc R U .
C36E C 0.4122(4) 0.1919(2) 0.5143(4) 0.1171(12) Uani 1 1 d G U .
H36E H 0.4203 0.1612 0.5174 0.141 Uiso 1 1 calc R U .
N41E N 0.6536(3) 0.3052(2) 0.5719(3) 0.1086(12) Uani 1 1 d G U .
C42E C 0.6255(2) 0.3436(3) 0.5520(4) 0.1079(11) Uani 1 1 d G U .
C43E C 0.6528(3) 0.3766(2) 0.5300(4) 0.1074(12) Uani 1 1 d G U .
H43E H 0.6336 0.4028 0.5164 0.129 Uiso 1 1 calc R U .
C44E C 0.7082(3) 0.3712(2) 0.5279(4) 0.1076(13) Uani 1 1 d G U .
H44E H 0.7269 0.3938 0.5128 0.129 Uiso 1 1 calc R U .
C45E C 0.7363(2) 0.3329(3) 0.5477(4) 0.1083(13) Uani 1 1 d G U .
H45E H 0.7742 0.3292 0.5463 0.130 Uiso 1 1 calc R U .
C46E C 0.7090(3) 0.2999(2) 0.5697(4) 0.1087(13) Uani 1 1 d G U .
H46E H 0.7282 0.2736 0.5833 0.130 Uiso 1 1 calc R U .
N51E N 0.4923(3) 0.3256(2) 0.5809(4) 0.1102(11) Uani 1 1 d G U .
N52E N 0.5460(3) 0.3115(2) 0.5768(4) 0.1091(11) Uani 1 1 d G U .
C53E C 0.5726(3) 0.3472(3) 0.5566(4) 0.1086(11) Uani 1 1 d G U .
C54E C 0.5352(4) 0.3835(2) 0.5482(4) 0.1091(12) Uani 1 1 d G U .
H54E H 0.5422 0.4117 0.5349 0.131 Uiso 1 1 calc R U .
C55E C 0.4856(3) 0.3701(3) 0.5632(4) 0.1099(12) Uani 1 1 d G U .
H55E H 0.4535 0.3878 0.5617 0.132 Uiso 1 1 calc R U .
C56E C 0.4543(5) 0.2958(5) 0.5947(6) 0.1116(11) Uani 1 1 d . U .
H56I H 0.4256 0.3130 0.6077 0.134 Uiso 1 1 calc R U .
H56J H 0.4742 0.2777 0.6256 0.134 Uiso 1 1 calc R U .
N11F N 0.1898(3) 0.1010(3) 0.5310(4) 0.1222(14) Uani 1 1 d G U .
C12F C 0.1404(3) 0.0873(3) 0.4969(3) 0.1220(12) Uani 1 1 d G U .
C13F C 0.0935(3) 0.0804(3) 0.5178(4) 0.1233(13) Uani 1 1 d G U .
H13F H 0.0597 0.0711 0.4946 0.148 Uiso 1 1 calc R U .
C14F C 0.0960(3) 0.0872(3) 0.5728(4) 0.1240(14) Uani 1 1 d G U .
H14F H 0.0640 0.0824 0.5871 0.149 Uiso 1 1 calc R U .
C15F C 0.1454(4) 0.1008(3) 0.6068(3) 0.1238(14) Uani 1 1 d G U .
H15F H 0.1472 0.1054 0.6444 0.149 Uiso 1 1 calc R U .
C16F C 0.1923(3) 0.1077(3) 0.5859(3) 0.1230(14) Uani 1 1 d G U .
H16F H 0.2261 0.1170 0.6092 0.148 Uiso 1 1 calc R U .
N21F N 0.1839(3) 0.0903(3) 0.3723(3) 0.1199(12) Uani 1 1 d G U .
N22F N 0.1922(3) 0.0946(3) 0.4296(3) 0.1198(12) Uani 1 1 d G U .
C23F C 0.1428(4) 0.0809(3) 0.4448(3) 0.1208(12) Uani 1 1 d G U .
C24F C 0.1039(3) 0.0682(3) 0.3969(4) 0.1209(13) Uani 1 1 d G U .
H24F H 0.0673 0.0577 0.3952 0.145 Uiso 1 1 calc R U .
C25F C 0.1293(3) 0.0740(3) 0.3521(3) 0.1206(13) Uani 1 1 d G U .
H25F H 0.1126 0.0680 0.3152 0.145 Uiso 1 1 calc R U .
C26F C 0.2239(5) 0.1009(5) 0.3445(7) 0.1197(12) Uani 1 1 d . U .
H26K H 0.2479 0.1244 0.3644 0.144 Uiso 1 1 calc R U .
H26L H 0.2058 0.1127 0.3083 0.144 Uiso 1 1 calc R U .
C31F C 0.2604(3) 0.0610(3) 0.3371(4) 0.1196(12) Uani 1 1 d G U .
C32F C 0.3059(4) 0.0699(2) 0.3147(4) 0.1196(12) Uani 1 1 d G U .
H32F H 0.3127 0.0991 0.3043 0.144 Uiso 1 1 calc R U .
C33F C 0.3415(3) 0.0360(3) 0.3077(4) 0.1196(12) Uani 1 1 d G U .
H33F H 0.3726 0.0420 0.2924 0.144 Uiso 1 1 calc R U .
C34F C 0.3317(3) -0.0068(3) 0.3230(4) 0.1195(12) Uani 1 1 d G U .
C35F C 0.2862(4) -0.0157(2) 0.3453(4) 0.1197(12) Uani 1 1 d G U .
H35F H 0.2795 -0.0449 0.3558 0.144 Uiso 1 1 calc R U .
C36F C 0.2506(3) 0.0182(3) 0.3524(4) 0.1198(12) Uani 1 1 d G U .
H36F H 0.2195 0.0122 0.3676 0.144 Uiso 1 1 calc R U .
N41F N 0.2573(4) -0.1318(3) 0.1618(3) 0.1223(14) Uani 1 1 d G U .
C42F C 0.3021(3) -0.1127(3) 0.1454(4) 0.1216(13) Uani 1 1 d G U .
C43F C 0.3095(3) -0.1198(3) 0.0931(4) 0.1227(14) Uani 1 1 d G U .
H43F H 0.3401 -0.1067 0.0819 0.147 Uiso 1 1 calc R U .
C44F C 0.2721(4) -0.1459(3) 0.0571(3) 0.1236(14) Uani 1 1 d G U .
H44F H 0.2771 -0.1507 0.0213 0.148 Uiso 1 1 calc R U .
C45F C 0.2273(3) -0.1650(3) 0.0735(3) 0.1235(15) Uani 1 1 d G U .
H45F H 0.2018 -0.1828 0.0489 0.148 Uiso 1 1 calc R U .
C46F C 0.2199(3) -0.1580(3) 0.1258(4) 0.1230(14) Uani 1 1 d G U .
H46F H 0.1893 -0.1710 0.1370 0.148 Uiso 1 1 calc R U .
N51F N 0.3698(3) -0.0541(3) 0.2635(3) 0.1192(12) Uani 1 1 d G U .
N52F N 0.3285(3) -0.0829(3) 0.2341(4) 0.1192(12) Uani 1 1 d G U .
C53F C 0.3353(4) -0.0851(3) 0.1798(3) 0.1200(12) Uani 1 1 d G U .
C54F C 0.3807(4) -0.0576(3) 0.1756(3) 0.1198(13) Uani 1 1 d G U .
H54F H 0.3944 -0.0529 0.1437 0.144 Uiso 1 1 calc R U .
C55F C 0.4020(3) -0.0384(3) 0.2273(4) 0.1195(12) Uani 1 1 d G U .
H55F H 0.4325 -0.0186 0.2362 0.143 Uiso 1 1 calc R U .
C56F C 0.3723(6) -0.0451(5) 0.3175(6) 0.1194(12) Uani 1 1 d . U .
H56K H 0.4106 -0.0366 0.3355 0.143 Uiso 1 1 calc R U .
H56L H 0.3622 -0.0718 0.3357 0.143 Uiso 1 1 calc R U .
P1 P 0.2675(4) 0.3095(3) 0.3613(4) 0.213(3) Uiso 1 1 d . . .
F1 F 0.2864(6) 0.3213(5) 0.3078(5) 0.279(8) Uiso 1 1 d D . .
F2 F 0.2107(5) 0.2919(4) 0.3272(5) 0.243(6) Uiso 1 1 d D . .
F4 F 0.2921(6) 0.2584(4) 0.3545(6) 0.280(8) Uiso 1 1 d D . .
F3 F 0.3278(5) 0.3205(4) 0.3956(5) 0.242(6) Uiso 1 1 d D . .
F5 F 0.2463(6) 0.3539(4) 0.3687(6) 0.268(7) Uiso 1 1 d D . .
F6 F 0.2522(6) 0.2912(5) 0.4154(5) 0.267(7) Uiso 1 1 d D . .
P2 P 0.40046(15) 0.49572(12) 0.52633(15) 0.1090(11) Uani 1 1 d . . .
F21 F 0.3738(5) 0.4505(4) 0.4996(5) 0.173(4) Uiso 1 1 d . . .
F22 F 0.4069(3) 0.5112(3) 0.4698(3) 0.118(2) Uiso 1 1 d . . .
F23 F 0.4592(4) 0.4732(3) 0.5358(4) 0.138(3) Uiso 1 1 d . . .
F24 F 0.4288(3) 0.5393(3) 0.5509(3) 0.126(2) Uiso 1 1 d . . .
F25 F 0.3947(4) 0.4827(3) 0.5838(4) 0.152(3) Uiso 1 1 d . . .
F26 F 0.3407(4) 0.5190(3) 0.5156(4) 0.141(3) Uiso 1 1 d . . .
P3 P 0.97148(17) 0.00580(15) 0.0986(3) 0.151(2) Uani 1 1 d . . .
F31 F 0.9121(6) 0.0169(4) 0.1078(5) 0.201(5) Uiso 1 1 d . . .
F32 F 1.0003(7) 0.0490(6) 0.1239(7) 0.243(6) Uiso 1 1 d . . .
F33 F 0.9846(5) -0.0218(4) 0.1558(4) 0.166(3) Uiso 1 1 d . . .
F34 F 0.9616(5) 0.0257(4) 0.0397(5) 0.174(4) Uiso 1 1 d . . .
F35 F 0.9485(6) -0.0399(5) 0.0758(5) 0.199(5) Uiso 1 1 d . . .
F36 F 1.0284(4) -0.0134(3) 0.0915(4) 0.156(3) Uiso 1 1 d . . .
P4 P 0.5846(3) 0.0569(2) 0.9975(4) 0.200(3) Uani 1 1 d . . .
F41 F 0.6262(6) 0.0968(4) 1.0156(6) 0.250(7) Uiso 1 1 d D . .
F42 F 0.6255(6) 0.0273(5) 1.0446(5) 0.314(10) Uiso 1 1 d D . .
F43 F 0.5452(5) 0.0153(4) 0.9847(6) 0.271(7) Uiso 1 1 d D . .
F44 F 0.6188(5) 0.0411(4) 0.9569(5) 0.230(6) Uiso 1 1 d D . .
F45 F 0.5459(6) 0.0848(5) 0.9558(6) 0.338(11) Uiso 1 1 d D . .
F46 F 0.5530(6) 0.0708(5) 1.0436(6) 0.285(8) Uiso 1 1 d D . .
P5 P 0.1741(4) 0.4836(3) 0.5316(4) 0.225(3) Uiso 1 1 d . . .
F51 F 0.1500(6) 0.5097(5) 0.5752(5) 0.253(7) Uiso 1 1 d D . .
F52 F 0.1381(6) 0.4464(4) 0.5300(6) 0.300(9) Uiso 1 1 d D . .
F53 F 0.2220(6) 0.4643(5) 0.5797(6) 0.361(12) Uiso 1 1 d D . .
F54 F 0.2069(6) 0.4629(5) 0.4892(6) 0.263(7) Uiso 1 1 d D . .
F55 F 0.2181(5) 0.5273(4) 0.5340(6) 0.252(7) Uiso 1 1 d D . .
F56 F 0.1353(5) 0.5092(4) 0.4842(5) 0.252(7) Uiso 1 1 d D . .
P6 P 0.3651(5) 0.1809(3) 0.2646(4) 0.239(4) Uiso 1 1 d . . .
F64 F 0.3332(7) 0.1888(5) 0.2054(5) 0.264(7) Uiso 1 1 d D . .
F63 F 0.4221(6) 0.1901(7) 0.2490(8) 0.410(15) Uiso 1 1 d D . .
F65 F 0.3591(8) 0.2291(4) 0.2804(7) 0.314(10) Uiso 1 1 d D . .
F62 F 0.3717(8) 0.1290(4) 0.2498(7) 0.315(10) Uiso 1 1 d D . .
F61 F 0.3977(7) 0.1691(6) 0.3251(6) 0.301(9) Uiso 1 1 d D . .
F66 F 0.3088(6) 0.1683(6) 0.2812(7) 0.312(9) Uiso 1 1 d D . .
P7 P 0.7500 0.3400(3) 0.2500 0.148(2) Uani 1 2 d S T P
F71 F 0.7460(6) 0.3058(5) 0.2952(6) 0.199(5) Uiso 1 1 d . . .
F72 F 0.8153(6) 0.3413(5) 0.2657(6) 0.209(5) Uiso 1 1 d . . .
F73 F 0.7547(9) 0.3782(7) 0.2983(9) 0.285(8) Uiso 1 1 d . . .
P8 P 0.2500 0.1751(2) 0.7500 0.138(2) Uani 1 2 d S T P
F81 F 0.2331(6) 0.1749(5) 0.6858(5) 0.236(6) Uiso 1 1 d D . .
F83 F 0.2996(5) 0.2048(4) 0.7491(5) 0.211(5) Uiso 1 1 d D . .
F82 F 0.1957(6) 0.1430(5) 0.7483(8) 0.316(10) Uiso 1 1 d D . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 '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'
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
N21B Ru1 N22C 102.0(3) . .
N21B Ru1 N11A 87.2(3) . .
N22C Ru1 N11A 170.7(3) . .
N21B Ru1 N11C 169.8(3) . .
N22C Ru1 N11C 77.2(3) . .
N11A Ru1 N11C 93.8(3) . .
N21B Ru1 N11B 76.3(3) . .
N22C Ru1 N11B 88.0(4) . .
N11A Ru1 N11B 94.8(4) . .
N11C Ru1 N11B 93.5(3) . .
N21B Ru1 N22A 102.2(3) . .
N22C Ru1 N22A 99.4(4) . .
N11A Ru1 N22A 77.8(4) . .
N11C Ru1 N22A 87.8(3) . .
N11B Ru1 N22A 172.5(4) . .
N22D Ru2 N22F 102.0(3) . .
N22D Ru2 N22E 101.1(4) . .
N22F Ru2 N22E 100.8(4) . .
N22D Ru2 N11F 88.8(4) . .
N22F Ru2 N11F 77.4(4) . .
N22E Ru2 N11F 170.1(4) . .
N22D Ru2 N11D 76.7(3) . .
N22F Ru2 N11D 170.6(4) . .
N22E Ru2 N11D 88.5(3) . .
N11F Ru2 N11D 93.2(3) . .
N22D Ru2 N11E 170.9(3) . .
N22F Ru2 N11E 87.1(3) . .
N22E Ru2 N11E 76.5(4) . .
N11F Ru2 N11E 93.6(4) . .
N11D Ru2 N11E 94.4(3) . .
N52D Ag1 N41C 121.8(3) . .
N52D Ag1 N52C 132.3(3) . .
N41C Ag1 N52C 71.1(3) . .
N52D Ag1 N41D 71.3(3) . .
N41C Ag1 N41D 156.7(3) . .
N52C Ag1 N41D 116.2(3) . .
N52F Ag2 N52F 129.0(9) . 2
N52F Ag2 N41F 120.5(3) . 2
N52F Ag2 N41F 71.1(7) 2 2
N52F Ag2 N41F 71.1(3) . .
N52F Ag2 N41F 120.5(8) 2 .
N41F Ag2 N41F 155.3(4) 2 .
N41B Ag3 N41B 156.6(4) 2 .
N41B Ag3 N52B 120.0(3) 2 .
N41B Ag3 N52B 70.7(3) . .
N41B Ag3 N52B 70.7(7) 2 2
N41B Ag3 N52B 120.0(7) . 2
N52B Ag3 N52B 130.8(10) . 2
N41E Ag4 N52A 123.8(3) . .
N41E Ag4 N41A 152.1(3) . .
N52A Ag4 N41A 73.4(3) . .
N41E Ag4 N52E 71.4(3) . .
N52A Ag4 N52E 125.7(3) . .
N41A Ag4 N52E 118.8(3) . .
C12A N11A C16A 120.0 . .
C12A N11A Ru1 114.6(6) . .
C16A N11A Ru1 125.4(6) . .
C23A C12A C13A 123.1(8) . .
C23A C12A N11A 116.9(8) . .
C13A C12A N11A 120.0 . .
C12A C13A C14A 120.0 . .
C12A C13A H13A 120.0 . .
C14A C13A H13A 120.0 . .
C15A C14A C13A 120.0 . .
C15A C14A H14A 120.0 . .
C13A C14A H14A 120.0 . .
C14A C15A C16A 120.0 . .
C14A C15A H15A 120.0 . .
C16A C15A H15A 120.0 . .
C15A C16A N11A 120.0 . .
C15A C16A H16A 120.0 . .
N11A C16A H16A 120.0 . .
C26A N21A C25A 132.9(10) . .
C26A N21A N22A 118.8(10) . .
C25A N21A N22A 108.0 . .
C23A N22A N21A 108.0 . .
C23A N22A Ru1 112.2(6) . .
N21A N22A Ru1 139.1(6) . .
C12A C23A N22A 116.7(9) . .
C12A C23A C24A 134.8(9) . .
N22A C23A C24A 108.0 . .
C23A C24A C25A 108.0 . .
C23A C24A H24A 126.0 . .
C25A C24A H24A 126.0 . .
N21A C25A C24A 108.0 . .
N21A C25A H25A 126.0 . .
C24A C25A H25A 126.0 . .
N21A C26A C31A 113.7(11) . .
N21A C26A H26A 108.8 . .
C31A C26A H26A 108.8 . .
N21A C26A H26B 108.8 . .
C31A C26A H26B 108.8 . .
H26A C26A H26B 107.7 . .
C32A C31A C36A 120.0 . .
C32A C31A C26A 124.2(9) . .
C36A C31A C26A 115.5(9) . .
C33A C32A C31A 120.0 . .
C33A C32A H32A 120.0 . .
C31A C32A H32A 120.0 . .
C34A C33A C32A 120.0 . .
C34A C33A H33A 120.0 . .
C32A C33A H33A 120.0 . .
C35A C34A C33A 120.0 . .
C35A C34A C56A 118.0(9) . 2
C33A C34A C56A 122.0(9) . 2
C36A C35A C34A 120.0 . .
C36A C35A H35A 120.0 . .
C34A C35A H35A 120.0 . .
C35A C36A C31A 120.0 . .
C35A C36A H36A 120.0 . .
C31A C36A H36A 120.0 . .
C42A N41A C46A 120.0 . .
C42A N41A Ag4 115.3(5) . .
C46A N41A Ag4 123.5(5) . .
N41A C42A C43A 120.0 . .
N41A C42A C53A 116.3(7) . .
C43A C42A C53A 123.6(7) . .
C44A C43A C42A 120.0 . .
C44A C43A H43A 120.0 . .
C42A C43A H43A 120.0 . .
C43A C44A C45A 120.0 . .
C43A C44A H44A 120.0 . .
C45A C44A H44A 120.0 . .
C46A C45A C44A 120.0 . .
C46A C45A H45A 120.0 . .
C44A C45A H45A 120.0 . .
C45A C46A N41A 120.0 . .
C45A C46A H46A 120.0 . .
N41A C46A H46A 120.0 . .
C56A N51A N52A 122.4(10) . .
C56A N51A C55A 129.5(10) . .
N52A N51A C55A 108.0 . .
C53A N52A N51A 108.0 . .
C53A N52A Ag4 113.6(5) . .
N51A N52A Ag4 138.3(5) . .
N52A C53A C54A 108.0 . .
N52A C53A C42A 119.3(7) . .
C54A C53A C42A 132.7(7) . .
C53A C54A C55A 108.0 . .
C53A C54A H54A 126.0 . .
C55A C54A H54A 126.0 . .
N51A C55A C54A 108.0 . .
N51A C55A H55A 126.0 . .
C54A C55A H55A 126.0 . .
N51A C56A C34A 114(3) . 2
N51A C56A H56A 108.8 . .
C34A C56A H56A 108.8 2 .
N51A C56A H56B 108.8 . .
C34A C56A H56B 108.8 2 .
H56A C56A H56B 107.7 . .
C12B N11B C16B 120.0 . .
C12B N11B Ru1 115.4(4) . .
C16B N11B Ru1 124.4(4) . .
C25B C12B C13B 124.5(6) . .
C25B C12B N11B 115.5(6) . .
C13B C12B N11B 120.0 . .
C12B C13B C14B 120.0 . .
C12B C13B H13B 120.0 . .
C14B C13B H13B 120.0 . .
C15B C14B C13B 120.0 . .
C15B C14B H14B 120.0 . .
C13B C14B H14B 120.0 . .
C14B C15B C16B 120.0 . .
C14B C15B H15B 120.0 . .
C16B C15B H15B 120.0 . .
C15B C16B N11B 120.0 . .
C15B C16B H16B 120.0 . .
N11B C16B H16B 120.0 . .
C25B N21B N22B 108.0 . .
C25B N21B Ru1 115.0(4) . .
N22B N21B Ru1 136.8(4) . .
C23B N22B N21B 108.0 . .
C23B N22B C26B 127.7(7) . .
N21B N22B C26B 124.1(7) . .
C24B C23B N22B 108.0 . .
C24B C23B H23B 126.0 . .
N22B C23B H23B 126.0 . .
C23B C24B C25B 108.0 . .
C23B C24B H24B 126.0 . .
C25B C24B H24B 126.0 . .
C12B C25B N21B 116.6(6) . .
C12B C25B C24B 135.1(6) . .
N21B C25B C24B 108.0 . .
N22B C26B C31B 112.5(10) . .
N22B C26B H26C 109.1 . .
C31B C26B H26C 109.1 . .
N22B C26B H26D 109.1 . .
C31B C26B H26D 109.1 . .
H26C C26B H26D 107.8 . .
C32B C31B C36B 120.0 . .
C32B C31B C26B 122.4(7) . .
C36B C31B C26B 117.5(7) . .
C31B C32B C33B 120.0 . .
C31B C32B H32B 120.0 . .
C33B C32B H32B 120.0 . .
C32B C33B C34B 120.0 . .
C32B C33B H33B 120.0 . .
C34B C33B H33B 120.0 . .
C35B C34B C33B 120.0 . .
C35B C34B C56B 119.1(8) . .
C33B C34B C56B 120.9(8) . .
C34B C35B C36B 120.0 . .
C34B C35B H35B 120.0 . .
C36B C35B H35B 120.0 . .
C35B C36B C31B 120.0 . .
C35B C36B H36B 120.0 . .
C31B C36B H36B 120.0 . .
C42B N41B C46B 120.0 . .
C42B N41B Ag3 117.9(4) . .
C46B N41B Ag3 122.1(4) . .
C53B C42B N41B 116.7(7) . .
C53B C42B C43B 123.3(7) . .
N41B C42B C43B 120.0 . .
C42B C43B C44B 120.0 . .
C42B C43B H43B 120.0 . .
C44B C43B H43B 120.0 . .
C45B C44B C43B 120.0 . .
C45B C44B H44B 120.0 . .
C43B C44B H44B 120.0 . .
C44B C45B C46B 120.0 . .
C44B C45B H45B 120.0 . .
C46B C45B H45B 120.0 . .
C45B C46B N41B 120.0 . .
C45B C46B H46B 120.0 . .
N41B C46B H46B 120.0 . .
C56B N51B N52B 121.1(8) . .
C56B N51B C55B 130.9(8) . .
N52B N51B C55B 108.0 . .
N51B N52B C53B 108.0 . .
N51B N52B Ag3 136.4(4) . .
C53B N52B Ag3 114.6(4) . .
C42B C53B N52B 119.7(7) . .
C42B C53B C54B 132.3(7) . .
N52B C53B C54B 108.0 . .
C53B C54B C55B 108.0 . .
C53B C54B H54B 126.0 . .
C55B C54B H54B 126.0 . .
N51B C55B C54B 108.0 . .
N51B C55B H55B 126.0 . .
C54B C55B H55B 126.0 . .
N51B C56B C34B 108.4(9) . .
N51B C56B H56C 110.0 . .
C34B C56B H56C 110.0 . .
N51B C56B H56D 110.0 . .
C34B C56B H56D 110.0 . .
H56C C56B H56D 108.4 . .
C12C N11C C16C 120.0 . .
C12C N11C Ru1 116.0(4) . .
C16C N11C Ru1 124.0(4) . .
C23C C12C C13C 125.7(6) . .
C23C C12C N11C 114.2(6) . .
C13C C12C N11C 120.0 . .
C12C C13C C14C 120.0 . .
C12C C13C H13C 120.0 . .
C14C C13C H13C 120.0 . .
C15C C14C C13C 120.0 . .
C15C C14C H14C 120.0 . .
C13C C14C H14C 120.0 . .
C14C C15C C16C 120.0 . .
C14C C15C H15C 120.0 . .
C16C C15C H15C 120.0 . .
C15C C16C N11C 120.0 . .
C15C C16C H16C 120.0 . .
N11C C16C H16C 120.0 . .
C26C N21C C25C 129.7(8) . .
C26C N21C N22C 121.3(9) . .
C25C N21C N22C 108.0 . .
C23C N22C N21C 108.0 . .
C23C N22C Ru1 113.4(4) . .
N21C N22C Ru1 138.5(4) . .
C12C C23C C24C 133.1(7) . .
C12C C23C N22C 118.6(7) . .
C24C C23C N22C 108.0 . .
C23C C24C C25C 108.0 . .
C23C C24C H24C 126.0 . .
C25C C24C H24C 126.0 . .
C24C C25C N21C 108.0 . .
C24C C25C H25C 126.0 . .
N21C C25C H25C 126.0 . .
N21C C26C C31C 115.9(11) . .
N21C C26C H26E 108.3 . .
C31C C26C H26E 108.3 . .
N21C C26C H26F 108.3 . .
C31C C26C H26F 108.3 . .
H26E C26C H26F 107.4 . .
C32C C31C C36C 120.0 . .
C32C C31C C26C 124.2(7) . .
C36C C31C C26C 115.8(7) . .
C31C C32C C33C 120.0 . .
C31C C32C H32C 120.0 . .
C33C C32C H32C 120.0 . .
C34C C33C C32C 120.0 . .
C34C C33C H33C 120.0 . .
C32C C33C H33C 120.0 . .
C33C C34C C35C 120.0 . .
C33C C34C C56C 118.6(7) . .
C35C C34C C56C 121.4(7) . .
C34C C35C C36C 120.0 . .
C34C C35C H35C 120.0 . .
C36C C35C H35C 120.0 . .
C35C C36C C31C 120.0 . .
C35C C36C H36C 120.0 . .
C31C C36C H36C 120.0 . .
C42C N41C C46C 120.0 . .
C42C N41C Ag1 117.1(5) . .
C46C N41C Ag1 122.8(5) . .
C53C C42C C43C 123.9(8) . .
C53C C42C N41C 116.1(8) . .
C43C C42C N41C 120.0 . .
C44C C43C C42C 120.0 . .
C44C C43C H43C 120.0 . .
C42C C43C H43C 120.0 . .
C43C C44C C45C 120.0 . .
C43C C44C H44C 120.0 . .
C45C C44C H44C 120.0 . .
C46C C45C C44C 120.0 . .
C46C C45C H45C 120.0 . .
C44C C45C H45C 120.0 . .
C45C C46C N41C 120.0 . .
C45C C46C H46C 120.0 . .
N41C C46C H46C 120.0 . .
C56C N51C N52C 120.2(9) . .
C56C N51C C55C 131.7(9) . .
N52C N51C C55C 108.0 . .
C53C N52C N51C 108.0 . .
C53C N52C Ag1 112.7(5) . .
N51C N52C Ag1 138.2(5) . .
C42C C53C N52C 121.7(8) . .
C42C C53C C54C 130.2(8) . .
N52C C53C C54C 108.0 . .
C55C C54C C53C 108.0 . .
C55C C54C H54C 126.0 . .
C53C C54C H54C 126.0 . .
C54C C55C N51C 108.0 . .
C54C C55C H55C 126.0 . .
N51C C55C H55C 126.0 . .
N51C C56C C34C 108.8(12) . .
N51C C56C H56E 109.9 . .
C34C C56C H56E 109.9 . .
N51C C56C H56F 109.9 . .
C34C C56C H56F 109.9 . .
H56E C56C H56F 108.3 . .
C12D N11D C16D 120.0 . .
C12D N11D Ru2 116.2(4) . .
C16D N11D Ru2 123.8(4) . .
C23D C12D C13D 126.0(7) . .
C23D C12D N11D 114.0(7) . .
C13D C12D N11D 120.0 . .
C12D C13D C14D 120.0 . .
C12D C13D H13D 120.0 . .
C14D C13D H13D 120.0 . .
C15D C14D C13D 120.0 . .
C15D C14D H14D 120.0 . .
C13D C14D H14D 120.0 . .
C14D C15D C16D 120.0 . .
C14D C15D H15D 120.0 . .
C16D C15D H15D 120.0 . .
C15D C16D N11D 120.0 . .
C15D C16D H16D 120.0 . .
N11D C16D H16D 120.0 . .
C26D N21D N22D 123.0(9) . .
C26D N21D C25D 128.7(8) . .
N22D N21D C25D 108.0 . .
N21D N22D C23D 108.0 . .
N21D N22D Ru2 137.6(5) . .
C23D N22D Ru2 114.1(5) . .
C12D C23D C24D 133.6(7) . .
C12D C23D N22D 118.0(7) . .
C24D C23D N22D 108.0 . .
C23D C24D C25D 108.0 . .
C23D C24D H24D 126.0 . .
C25D C24D H24D 126.0 . .
C24D C25D N21D 108.0 . .
C24D C25D H25D 126.0 . .
N21D C25D H25D 126.0 . .
N21D C26D C31D 113.3(11) . .
N21D C26D H26G 108.9 . .
C31D C26D H26G 108.9 . .
N21D C26D H26H 108.9 . .
C31D C26D H26H 108.9 . .
H26G C26D H26H 107.7 . .
C32D C31D C36D 120.0 . .
C32D C31D C26D 117.2(7) . .
C36D C31D C26D 122.8(7) . .
C33D C32D C31D 120.0 . .
C33D C32D H32D 120.0 . .
C31D C32D H32D 120.0 . .
C32D C33D C34D 120.0 . .
C32D C33D H33D 120.0 . .
C34D C33D H33D 120.0 . .
C35D C34D C33D 120.0 . .
C35D C34D C56D 118.4(8) . .
C33D C34D C56D 121.4(8) . .
C34D C35D C36D 120.0 . .
C34D C35D H35D 120.0 . .
C36D C35D H35D 120.0 . .
C35D C36D C31D 120.0 . .
C35D C36D H36D 120.0 . .
C31D C36D H36D 120.0 . .
C42D N41D C46D 120.0 . .
C42D N41D Ag1 116.0(4) . .
C46D N41D Ag1 124.0(5) . .
C53D C42D N41D 115.8(7) . .
C53D C42D C43D 124.1(7) . .
N41D C42D C43D 120.0 . .
C44D C43D C42D 120.0 . .
C44D C43D H43D 120.0 . .
C42D C43D H43D 120.0 . .
C43D C44D C45D 120.0 . .
C43D C44D H44D 120.0 . .
C45D C44D H44D 120.0 . .
C44D C45D C46D 120.0 . .
C44D C45D H45D 120.0 . .
C46D C45D H45D 120.0 . .
C45D C46D N41D 120.0 . .
C45D C46D H46D 120.0 . .
N41D C46D H46D 120.0 . .
C56D N51D C55D 133.9(9) . .
C56D N51D N52D 118.0(9) . .
C55D N51D N52D 108.0 . .
C53D N52D N51D 108.0 . .
C53D N52D Ag1 114.0(5) . .
N51D N52D Ag1 136.2(5) . .
C42D C53D N52D 121.3(8) . .
C42D C53D C54D 130.7(8) . .
N52D C53D C54D 108.0 . .
C55D C54D C53D 108.0 . .
C55D C54D H54D 126.0 . .
C53D C54D H54D 126.0 . .
C54D C55D N51D 108.0 . .
C54D C55D H55D 126.0 . .
N51D C55D H55D 126.0 . .
N51D C56D C34D 112.2(12) . .
N51D C56D H56G 109.2 . .
C34D C56D H56G 109.2 . .
N51D C56D H56H 109.2 . .
C34D C56D H56H 109.2 . .
H56G C56D H56H 107.9 . .
C12E N11E C16E 120.0 . .
C12E N11E Ru2 116.7(5) . .
C16E N11E Ru2 123.3(5) . .
C23E C12E C13E 127.8(7) . .
C23E C12E N11E 112.2(7) . .
C13E C12E N11E 120.0 . .
C12E C13E C14E 120.0 . .
C12E C13E H13E 120.0 . .
C14E C13E H13E 120.0 . .
C15E C14E C13E 120.0 . .
C15E C14E H14E 120.0 . .
C13E C14E H14E 120.0 . .
C14E C15E C16E 120.0 . .
C14E C15E H15E 120.0 . .
C16E C15E H15E 120.0 . .
C15E C16E N11E 120.0 . .
C15E C16E H16E 120.0 . .
N11E C16E H16E 120.0 . .
C26E N21E C25E 129.4(9) . .
C26E N21E N22E 122.5(9) . .
C25E N21E N22E 108.0 . .
N21E N22E C23E 108.0 . .
N21E N22E Ru2 137.7(5) . .
C23E N22E Ru2 113.7(5) . .
C12E C23E C24E 132.3(8) . .
C12E C23E N22E 119.1(8) . .
C24E C23E N22E 108.0 . .
C25E C24E C23E 108.0 . .
C25E C24E H24E 126.0 . .
C23E C24E H24E 126.0 . .
N21E C25E C24E 108.0 . .
N21E C25E H25E 126.0 . .
C24E C25E H25E 126.0 . .
N21E C26E C31E 117.8(11) . .
N21E C26E H26I 107.8 . .
C31E C26E H26I 107.8 . .
N21E C26E H26J 107.8 . .
C31E C26E H26J 107.8 . .
H26I C26E H26J 107.2 . .
C32E C31E C36E 120.0 . .
C32E C31E C26E 121.6(8) . .
C36E C31E C26E 118.2(8) . .
C31E C32E C33E 120.0 . .
C31E C32E H32E 120.0 . .
C33E C32E H32E 120.0 . .
C32E C33E C34E 120.0 . .
C32E C33E H33E 120.0 . .
C34E C33E H33E 120.0 . .
C33E C34E C35E 120.0 . .
C33E C34E C56E 120.8(8) . .
C35E C34E C56E 119.1(8) . .
C36E C35E C34E 120.0 . .
C36E C35E H35E 120.0 . .
C34E C35E H35E 120.0 . .
C35E C36E C31E 120.0 . .
C35E C36E H36E 120.0 . .
C31E C36E H36E 120.0 . .
C42E N41E C46E 120.0 . .
C42E N41E Ag4 116.3(4) . .
C46E N41E Ag4 122.6(4) . .
C53E C42E C43E 122.8(6) . .
C53E C42E N41E 117.1(6) . .
C43E C42E N41E 120.0 . .
C42E C43E C44E 120.0 . .
C42E C43E H43E 120.0 . .
C44E C43E H43E 120.0 . .
C45E C44E C43E 120.0 . .
C45E C44E H44E 120.0 . .
C43E C44E H44E 120.0 . .
C44E C45E C46E 120.0 . .
C44E C45E H45E 120.0 . .
C46E C45E H45E 120.0 . .
C45E C46E N41E 120.0 . .
C45E C46E H46E 120.0 . .
N41E C46E H46E 120.0 . .
C56E N51E C55E 130.8(8) . .
C56E N51E N52E 120.8(8) . .
C55E N51E N52E 108.0 . .
N51E N52E C53E 108.0 . .
N51E N52E Ag4 138.8(4) . .
C53E N52E Ag4 113.2(4) . .
C42E C53E C54E 131.6(7) . .
C42E C53E N52E 120.2(7) . .
C54E C53E N52E 108.0 . .
C53E C54E C55E 108.0 . .
C53E C54E H54E 126.0 . .
C55E C54E H54E 126.0 . .
N51E C55E C54E 108.0 . .
N51E C55E H55E 126.0 . .
C54E C55E H55E 126.0 . .
N51E C56E C34E 116.7(11) . .
N51E C56E H56I 108.1 . .
C34E C56E H56I 108.1 . .
N51E C56E H56J 108.1 . .
C34E C56E H56J 108.1 . .
H56I C56E H56J 107.3 . .
C12F N11F C16F 120.0 . .
C12F N11F Ru2 115.3(5) . .
C16F N11F Ru2 124.6(5) . .
C23F C12F C13F 124.9(7) . .
C23F C12F N11F 115.1(7) . .
C13F C12F N11F 120.0 . .
C14F C13F C12F 120.0 . .
C14F C13F H13F 120.0 . .
C12F C13F H13F 120.0 . .
C13F C14F C15F 120.0 . .
C13F C14F H14F 120.0 . .
C15F C14F H14F 120.0 . .
C16F C15F C14F 120.0 . .
C16F C15F H15F 120.0 . .
C14F C15F H15F 120.0 . .
C15F C16F N11F 120.0 . .
C15F C16F H16F 120.0 . .
N11F C16F H16F 120.0 . .
C26F N21F N22F 122.8(9) . .
C26F N21F C25F 129.2(9) . .
N22F N21F C25F 108.0 . .
C23F N22F N21F 108.0 . .
C23F N22F Ru2 113.9(5) . .
N21F N22F Ru2 137.7(5) . .
C12F C23F C24F 134.7(7) . .
C12F C23F N22F 116.8(7) . .
C24F C23F N22F 108.0 . .
C23F C24F C25F 108.0 . .
C23F C24F H24F 126.0 . .
C25F C24F H24F 126.0 . .
N21F C25F C24F 108.0 . .
N21F C25F H25F 126.0 . .
C24F C25F H25F 126.0 . .
N21F C26F C31F 112.7(12) . .
N21F C26F H26K 109.1 . .
C31F C26F H26K 109.1 . .
N21F C26F H26L 109.1 . .
C31F C26F H26L 109.1 . .
H26K C26F H26L 107.8 . .
C32F C31F C36F 120.0 . .
C32F C31F C26F 116.3(8) . .
C36F C31F C26F 123.6(8) . .
C31F C32F C33F 120.0 . .
C31F C32F H32F 120.0 . .
C33F C32F H32F 120.0 . .
C32F C33F C34F 120.0 . .
C32F C33F H33F 120.0 . .
C34F C33F H33F 120.0 . .
C35F C34F C33F 120.0 . .
C35F C34F C56F 119.0(9) . .
C33F C34F C56F 120.9(9) . .
C34F C35F C36F 120.0 . .
C34F C35F H35F 120.0 . .
C36F C35F H35F 120.0 . .
C35F C36F C31F 120.0 . .
C35F C36F H36F 120.0 . .
C31F C36F H36F 120.0 . .
C42F N41F C46F 120.0 . .
C42F N41F Ag2 115.5(4) . .
C46F N41F Ag2 124.4(4) . .
C53F C42F C43F 121.3(8) . .
C53F C42F N41F 118.6(8) . .
C43F C42F N41F 120.0 . .
C44F C43F C42F 120.0 . .
C44F C43F H43F 120.0 . .
C42F C43F H43F 120.0 . .
C45F C44F C43F 120.0 . .
C45F C44F H44F 120.0 . .
C43F C44F H44F 120.0 . .
C44F C45F C46F 120.0 . .
C44F C45F H45F 120.0 . .
C46F C45F H45F 120.0 . .
C45F C46F N41F 120.0 . .
C45F C46F H46F 120.0 . .
N41F C46F H46F 120.0 . .
C56F N51F N52F 120.6(9) . .
C56F N51F C55F 131.4(9) . .
N52F N51F C55F 108.0 . .
C53F N52F N51F 108.0 . .
C53F N52F Ag2 115.8(5) . .
N51F N52F Ag2 135.3(5) . .
C42F C53F N52F 117.8(8) . .
C42F C53F C54F 134.0(8) . .
N52F C53F C54F 108.0 . .
C53F C54F C55F 108.0 . .
C53F C54F H54F 126.0 . .
C55F C54F H54F 126.0 . .
N51F C55F C54F 108.0 . .
N51F C55F H55F 126.0 . .
C54F C55F H55F 126.0 . .
N51F C56F C34F 110.4(11) . .
N51F C56F H56K 109.6 . .
C34F C56F H56K 109.6 . .
N51F C56F H56L 109.6 . .
C34F C56F H56L 109.6 . .
H56K C56F H56L 108.1 . .
F5 P1 F2 94.7(7) . .
F5 P1 F1 94.7(7) . .
F2 P1 F1 90.3(7) . .
F5 P1 F3 93.2(7) . .
F2 P1 F3 172.1(9) . .
F1 P1 F3 90.0(7) . .
F5 P1 F6 93.0(7) . .
F2 P1 F6 89.8(7) . .
F1 P1 F6 172.3(9) . .
F3 P1 F6 88.8(7) . .
F5 P1 F4 178.7(9) . .
F2 P1 F4 85.9(6) . .
F1 P1 F4 86.5(7) . .
F3 P1 F4 86.2(6) . .
F6 P1 F4 85.8(6) . .
F25 P2 F22 177.1(5) . .
F25 P2 F24 88.3(5) . .
F22 P2 F24 88.9(4) . .
F25 P2 F23 91.1(5) . .
F22 P2 F23 89.5(5) . .
F24 P2 F23 89.4(5) . .
F25 P2 F26 89.9(6) . .
F22 P2 F26 89.4(5) . .
F24 P2 F26 90.6(5) . .
F23 P2 F26 178.9(6) . .
F25 P2 F21 93.6(6) . .
F22 P2 F21 89.3(5) . .
F24 P2 F21 177.1(6) . .
F23 P2 F21 88.3(6) . .
F26 P2 F21 91.7(6) . .
F35 P3 F32 174.0(9) . .
F35 P3 F36 83.7(7) . .
F32 P3 F36 91.1(8) . .
F35 P3 F31 88.2(7) . .
F32 P3 F31 96.7(9) . .
F36 P3 F31 170.5(7) . .
F35 P3 F34 91.5(7) . .
F32 P3 F34 91.4(8) . .
F36 P3 F34 89.4(7) . .
F31 P3 F34 95.9(7) . .
F35 P3 F33 81.8(7) . .
F32 P3 F33 94.8(8) . .
F36 P3 F33 84.5(6) . .
F31 P3 F33 89.3(7) . .
F34 P3 F33 171.3(7) . .
F45 P4 F44 93.8(8) . .
F45 P4 F43 92.2(7) . .
F44 P4 F43 91.2(7) . .
F45 P4 F46 91.3(6) . .
F44 P4 F46 174.9(9) . .
F43 P4 F46 88.9(6) . .
F45 P4 F41 92.4(7) . .
F44 P4 F41 90.7(6) . .
F43 P4 F41 174.9(9) . .
F46 P4 F41 88.7(7) . .
F45 P4 F42 177.8(9) . .
F44 P4 F42 88.5(6) . .
F43 P4 F42 88.0(6) . .
F46 P4 F42 86.4(7) . .
F41 P4 F42 87.4(7) . .
F52 P5 F56 95.7(8) . .
F52 P5 F51 95.0(8) . .
F56 P5 F51 91.3(7) . .
F52 P5 F53 94.7(8) . .
F56 P5 F53 169.5(10) . .
F51 P5 F53 89.0(7) . .
F52 P5 F54 94.3(8) . .
F56 P5 F54 90.0(7) . .
F51 P5 F54 170.4(9) . .
F53 P5 F54 88.0(7) . .
F52 P5 F55 178.8(10) . .
F56 P5 F55 85.4(7) . .
F51 P5 F55 85.5(7) . .
F53 P5 F55 84.2(7) . .
F54 P5 F55 85.2(7) . .
F64 P6 F65 92.6(8) . .
F64 P6 F63 91.3(8) . .
F65 P6 F63 92.2(8) . .
F64 P6 F66 90.4(8) . .
F65 P6 F66 91.2(8) . .
F63 P6 F66 176.2(11) . .
F64 P6 F61 176.2(10) . .
F65 P6 F61 91.2(8) . .
F63 P6 F61 89.3(8) . .
F66 P6 F61 88.8(8) . .
F64 P6 F62 89.1(8) . .
F65 P6 F62 178.2(10) . .
F63 P6 F62 88.5(8) . .
F66 P6 F62 88.1(8) . .
F61 P6 F62 87.1(7) . .
F72 P7 F72 177.2(12) . 2_655
F72 P7 F71 88.5(8) . 2_655
F72 P7 F71 93.3(8) 2_655 2_655
F72 P7 F71 93.4(8) . .
F72 P7 F71 88.5(8) 2_655 .
F71 P7 F71 96.6(11) 2_655 .
F72 P7 F73 84.1(9) . .
F72 P7 F73 94.0(10) 2_655 .
F71 P7 F73 172.2(9) 2_655 .
F71 P7 F73 86.2(9) . .
F72 P7 F73 94.0(10) . 2_655
F72 P7 F73 84.1(9) 2_655 2_655
F71 P7 F73 86.2(9) 2_655 2_655
F71 P7 F73 172.2(9) . 2_655
F73 P7 F73 92.0(16) . 2_655
F83 P8 F83 107.6(9) . 2_556
F83 P8 F81 89.2(8) . 2_556
F83 P8 F81 91.0(6) 2_556 2_556
F83 P8 F81 91.0(6) . .
F83 P8 F81 89.2(8) 2_556 .
F81 P8 F81 179.6(12) 2_556 .
F83 P8 F82 72.4(9) . 2_556
F83 P8 F82 177.7(8) 2_556 2_556
F81 P8 F82 86.7(7) 2_556 2_556
F81 P8 F82 93.1(9) . 2_556
F83 P8 F82 177.7(8) . .
F83 P8 F82 72.4(9) 2_556 .
F81 P8 F82 93.1(9) 2_556 .
F81 P8 F82 86.7(7) . .
F82 P8 F82 107.6(9) 2_556 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ru1 N21B 2.053(5) .
Ru1 N22C 2.058(7) .
Ru1 N11A 2.073(7) .
Ru1 N11C 2.087(5) .
Ru1 N11B 2.095(6) .
Ru1 N22A 2.096(7) .
Ru2 N22D 2.051(7) .
Ru2 N22F 2.049(6) .
Ru2 N22E 2.052(7) .
Ru2 N11F 2.080(7) .
Ru2 N11D 2.094(5) .
Ru2 N11E 2.120(7) .
Ag1 N52D 2.288(7) .
Ag1 N41C 2.328(7) .
Ag1 N52C 2.332(6) .
Ag1 N41D 2.354(7) .
Ag2 N52F 2.288(7) .
Ag2 N52F 2.288(12) 2
Ag2 N41F 2.328(7) 2
Ag2 N41F 2.328(7) .
Ag3 N41B 2.317(6) 2
Ag3 N41B 2.317(6) .
Ag3 N52B 2.330(7) .
Ag3 N52B 2.330(12) 2
Ag4 N41E 2.293(6) .
Ag4 N52A 2.299(7) .
Ag4 N41A 2.308(6) .
Ag4 N52E 2.321(6) .
N11A C12A 1.3900 .
N11A C16A 1.3900 .
C12A C23A 1.344(11) .
C12A C13A 1.3900 .
C13A C14A 1.3900 .
C13A H13A 0.9500 .
C14A C15A 1.3900 .
C14A H14A 0.9500 .
C15A C16A 1.3900 .
C15A H15A 0.9500 .
C16A H16A 0.9500 .
N21A C26A 1.367(16) .
N21A C25A 1.4200 .
N21A N22A 1.4200 .
N22A C23A 1.4200 .
C23A C24A 1.4200 .
C24A C25A 1.4200 .
C24A H24A 0.9500 .
C25A H25A 0.9500 .
C26A C31A 1.443(15) .
C26A H26A 0.9900 .
C26A H26B 0.9900 .
C31A C32A 1.3900 .
C31A C36A 1.3900 .
C32A C33A 1.3900 .
C32A H32A 0.9500 .
C33A C34A 1.3900 .
C33A H33A 0.9500 .
C34A C35A 1.3900 .
C34A C56A 1.582(15) 2
C35A C36A 1.3900 .
C35A H35A 0.9500 .
C36A H36A 0.9500 .
N41A C42A 1.3900 .
N41A C46A 1.3900 .
C42A C43A 1.3900 .
C42A C53A 1.440(10) .
C43A C44A 1.3900 .
C43A H43A 0.9500 .
C44A C45A 1.3900 .
C44A H44A 0.9500 .
C45A C46A 1.3900 .
C45A H45A 0.9500 .
C46A H46A 0.9500 .
N51A C56A 1.312(15) .
N51A N52A 1.4200 .
N51A C55A 1.4200 .
N52A C53A 1.4200 .
C53A C54A 1.4200 .
C54A C55A 1.4200 .
C54A H54A 0.9500 .
C55A H55A 0.9500 .
C56A C34A 1.58(6) 2
C56A H56A 0.9900 .
C56A H56B 0.9900 .
N11B C12B 1.3900 .
N11B C16B 1.3900 .
C12B C25B 1.329(8) .
C12B C13B 1.3900 .
C13B C14B 1.3900 .
C13B H13B 0.9500 .
C14B C15B 1.3900 .
C14B H14B 0.9500 .
C15B C16B 1.3900 .
C15B H15B 0.9500 .
C16B H16B 0.9500 .
N21B C25B 1.4200 .
N21B N22B 1.4200 .
N22B C23B 1.4200 .
N22B C26B 1.419(14) .
C23B C24B 1.4200 .
C23B H23B 0.9500 .
C24B C25B 1.4200 .
C24B H24B 0.9500 .
C26B C31B 1.529(14) .
C26B H26C 0.9900 .
C26B H26D 0.9900 .
C31B C32B 1.3900 .
C31B C36B 1.3900 .
C32B C33B 1.3900 .
C32B H32B 0.9500 .
C33B C34B 1.3900 .
C33B H33B 0.9500 .
C34B C35B 1.3900 .
C34B C56B 1.537(14) .
C35B C36B 1.3900 .
C35B H35B 0.9500 .
C36B H36B 0.9500 .
N41B C42B 1.3900 .
N41B C46B 1.3900 .
C42B C53B 1.357(8) .
C42B C43B 1.3900 .
C43B C44B 1.3900 .
C43B H43B 0.9500 .
C44B C45B 1.3900 .
C44B H44B 0.9500 .
C45B C46B 1.3900 .
C45B H45B 0.9500 .
C46B H46B 0.9500 .
N51B C56B 1.395(13) .
N51B N52B 1.4200 .
N51B C55B 1.4200 .
N52B C53B 1.4200 .
C53B C54B 1.4200 .
C54B C55B 1.4200 .
C54B H54B 0.9500 .
C55B H55B 0.9500 .
C56B H56C 0.9900 .
C56B H56D 0.9900 .
N11C C12C 1.3900 .
N11C C16C 1.3900 .
C12C C23C 1.337(9) .
C12C C13C 1.3900 .
C13C C14C 1.3900 .
C13C H13C 0.9500 .
C14C C15C 1.3900 .
C14C H14C 0.9500 .
C15C C16C 1.3900 .
C15C H15C 0.9500 .
C16C H16C 0.9500 .
N21C C26C 1.398(13) .
N21C C25C 1.4200 .
N21C N22C 1.4200 .
N22C C23C 1.4200 .
C23C C24C 1.4200 .
C24C C25C 1.4200 .
C24C H24C 0.9500 .
C25C H25C 0.9500 .
C26C C31C 1.497(15) .
C26C H26E 0.9900 .
C26C H26F 0.9900 .
C31C C32C 1.3900 .
C31C C36C 1.3900 .
C32C C33C 1.3900 .
C32C H32C 0.9500 .
C33C C34C 1.3900 .
C33C H33C 0.9500 .
C34C C35C 1.3900 .
C34C C56C 1.572(15) .
C35C C36C 1.3900 .
C35C H35C 0.9500 .
C36C H36C 0.9500 .
N41C C42C 1.3900 .
N41C C46C 1.3900 .
C42C C53C 1.338(10) .
C42C C43C 1.3900 .
C43C C44C 1.3900 .
C43C H43C 0.9500 .
C44C C45C 1.3900 .
C44C H44C 0.9500 .
C45C C46C 1.3900 .
C45C H45C 0.9500 .
C46C H46C 0.9500 .
N51C C56C 1.406(17) .
N51C N52C 1.4200 .
N51C C55C 1.4200 .
N52C C53C 1.4200 .
C53C C54C 1.4200 .
C54C C55C 1.4200 .
C54C H54C 0.9500 .
C55C H55C 0.9500 .
C56C H56E 0.9900 .
C56C H56F 0.9900 .
N11D C12D 1.3900 .
N11D C16D 1.3900 .
C12D C23D 1.336(9) .
C12D C13D 1.3900 .
C13D C14D 1.3900 .
C13D H13D 0.9500 .
C14D C15D 1.3900 .
C14D H14D 0.9500 .
C15D C16D 1.3900 .
C15D H15D 0.9500 .
C16D H16D 0.9500 .
N21D C26D 1.400(13) .
N21D N22D 1.4200 .
N21D C25D 1.4200 .
N22D C23D 1.4200 .
C23D C24D 1.4200 .
C24D C25D 1.4200 .
C24D H24D 0.9500 .
C25D H25D 0.9500 .
C26D C31D 1.539(14) .
C26D H26G 0.9900 .
C26D H26H 0.9900 .
C31D C32D 1.3900 .
C31D C36D 1.3900 .
C32D C33D 1.3900 .
C32D H32D 0.9500 .
C33D C34D 1.3900 .
C33D H33D 0.9500 .
C34D C35D 1.3900 .
C34D C56D 1.562(14) .
C35D C36D 1.3900 .
C35D H35D 0.9500 .
C36D H36D 0.9500 .
N41D C42D 1.3900 .
N41D C46D 1.3900 .
C42D C53D 1.346(9) .
C42D C43D 1.3900 .
C43D C44D 1.3900 .
C43D H43D 0.9500 .
C44D C45D 1.3900 .
C44D H44D 0.9500 .
C45D C46D 1.3900 .
C45D H45D 0.9500 .
C46D H46D 0.9500 .
N51D C56D 1.349(16) .
N51D C55D 1.4200 .
N51D N52D 1.4200 .
N52D C53D 1.4200 .
C53D C54D 1.4200 .
C54D C55D 1.4200 .
C54D H54D 0.9500 .
C55D H55D 0.9500 .
C56D H56G 0.9900 .
C56D H56H 0.9900 .
N11E C12E 1.3900 .
N11E C16E 1.3900 .
C12E C23E 1.360(11) .
C12E C13E 1.3900 .
C13E C14E 1.3900 .
C13E H13E 0.9500 .
C14E C15E 1.3900 .
C14E H14E 0.9500 .
C15E C16E 1.3900 .
C15E H15E 0.9500 .
C16E H16E 0.9500 .
N21E C26E 1.320(15) .
N21E C25E 1.4200 .
N21E N22E 1.4200 .
N22E C23E 1.4200 .
C23E C24E 1.4200 .
C24E C25E 1.4200 .
C24E H24E 0.9500 .
C25E H25E 0.9500 .
C26E C31E 1.579(15) .
C26E H26I 0.9900 .
C26E H26J 0.9900 .
C31E C32E 1.3900 .
C31E C36E 1.3900 .
C32E C33E 1.3900 .
C32E H32E 0.9500 .
C33E C34E 1.3900 .
C33E H33E 0.9500 .
C34E C35E 1.3900 .
C34E C56E 1.494(15) .
C35E C36E 1.3900 .
C35E H35E 0.9500 .
C36E H36E 0.9500 .
N41E C42E 1.3900 .
N41E C46E 1.3900 .
C42E C53E 1.343(8) .
C42E C43E 1.3900 .
C43E C44E 1.3900 .
C43E H43E 0.9500 .
C44E C45E 1.3900 .
C44E H44E 0.9500 .
C45E C46E 1.3900 .
C45E H45E 0.9500 .
C46E H46E 0.9500 .
N51E C56E 1.400(14) .
N51E C55E 1.4200 .
N51E N52E 1.4200 .
N52E C53E 1.4200 .
C53E C54E 1.4200 .
C54E C55E 1.4200 .
C54E H54E 0.9500 .
C55E H55E 0.9500 .
C56E H56I 0.9900 .
C56E H56J 0.9900 .
N11F C12F 1.3900 .
N11F C16F 1.3900 .
C12F C23F 1.346(10) .
C12F C13F 1.3900 .
C13F C14F 1.3900 .
C13F H13F 0.9500 .
C14F C15F 1.3900 .
C14F H14F 0.9500 .
C15F C16F 1.3900 .
C15F H15F 0.9500 .
C16F H16F 0.9500 .
N21F C26F 1.372(17) .
N21F N22F 1.4200 .
N21F C25F 1.4200 .
N22F C23F 1.4200 .
C23F C24F 1.4200 .
C24F C25F 1.4200 .
C24F H24F 0.9500 .
C25F H25F 0.9500 .
C26F C31F 1.545(14) .
C26F H26K 0.9900 .
C26F H26L 0.9900 .
C31F C32F 1.3900 .
C31F C36F 1.3900 .
C32F C33F 1.3900 .
C32F H32F 0.9500 .
C33F C34F 1.3900 .
C33F H33F 0.9500 .
C34F C35F 1.3900 .
C34F C56F 1.558(14) .
C35F C36F 1.3900 .
C35F H35F 0.9500 .
C36F H36F 0.9500 .
N41F C42F 1.3900 .
N41F C46F 1.3900 .
C42F C53F 1.346(8) .
C42F C43F 1.3900 .
C43F C44F 1.3900 .
C43F H43F 0.9500 .
C44F C45F 1.3900 .
C44F H44F 0.9500 .
C45F C46F 1.3900 .
C45F H45F 0.9500 .
C46F H46F 0.9500 .
N51F C56F 1.378(16) .
N51F N52F 1.4200 .
N51F C55F 1.4200 .
N52F C53F 1.4200 .
C53F C54F 1.4200 .
C54F C55F 1.4200 .
C54F H54F 0.9500 .
C55F H55F 0.9500 .
C56F H56K 0.9900 .
C56F H56L 0.9900 .
P1 F5 1.471(12) .
P1 F2 1.569(12) .
P1 F1 1.565(13) .
P1 F3 1.583(13) .
P1 F6 1.596(13) .
P1 F4 1.687(13) .
P2 F25 1.540(10) .
P2 F22 1.543(8) .
P2 F24 1.558(9) .
P2 F23 1.571(10) .
P2 F26 1.602(10) .
P2 F21 1.605(12) .
P3 F35 1.557(14) .
P3 F32 1.559(18) .
P3 F36 1.568(11) .
P3 F31 1.571(15) .
P3 F34 1.572(12) .
P3 F33 1.638(12) .
P4 F45 1.514(13) .
P4 F44 1.540(12) .
P4 F43 1.581(12) .
P4 F46 1.597(13) .
P4 F41 1.589(12) .
P4 F42 1.645(13) .
P5 F52 1.432(14) .
P5 F56 1.563(13) .
P5 F51 1.575(13) .
P5 F53 1.606(14) .
P5 F54 1.607(13) .
P5 F55 1.705(13) .
P6 F64 1.545(14) .
P6 F65 1.533(15) .
P6 F63 1.568(16) .
P6 F66 1.585(15) .
P6 F61 1.601(15) .
P6 F62 1.634(15) .
P7 F72 1.572(15) .
P7 F72 1.572(15) 2_655
P7 F71 1.562(14) 2_655
P7 F71 1.562(14) .
P7 F73 1.67(2) .
P7 F73 1.67(2) 2_655
P8 F83 1.524(12) .
P8 F83 1.524(12) 2_556
P8 F81 1.581(12) 2_556
P8 F81 1.581(12) .
P8 F82 1.649(13) 2_556
P8 F82 1.649(14) .
