#------------------------------------------------------------------------------
#$Date: 2016-03-22 12:01:59 +0200 (Tue, 22 Mar 2016) $
#$Revision: 178930 $
#$URL: svn://www.crystallography.net/cod/cif/4/11/59/4115928.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_4115928
loop_
_publ_author_name
'Ralf-Dieter Schnebeck'
'Eva Freisinger'
'Frank Glahé'
'Bernhard Lippert'
_publ_contact_author_address
; Fachbereich Chemie
  Universität Dortmund
  Otto-Hahn-Str. 6
  D-44221 Dortmund
  Germany
;
_publ_contact_author_email       lippert@pop.uni-dortmund.de
_publ_contact_author_fax         'Int. code + (231) 755-3797'
_publ_contact_author_name        'Prof. Bernhard Lippert'
_publ_contact_author_phone       '231 755-3840'
_publ_section_title
;
 Molecular Architecture Based on Metal Triangles Derived from
 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              1381
_journal_page_last               1390
_journal_paper_doi               10.1021/ja9931325
_journal_volume                  122
_journal_year                    2000
_chemical_formula_sum            'C30 H64 Ag2 N26 O35 Pt3'
_chemical_formula_weight         2150.08
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     patterson
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL
_cell_angle_alpha                90.00
_cell_angle_beta                 99.04(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   15.030(3)
_cell_length_b                   22.002(4)
_cell_length_c                   20.016(4)
_cell_measurement_reflns_used    14489
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      22.66
_cell_measurement_theta_min      1.37
_cell_volume                     6537(2)
_computing_cell_refinement       'DENZO, SCALEPACK (Otwinowski, Minor, 1997)'
_computing_data_collection       'KappaCCD (Nonius BV, Netherlands)'
_computing_data_reduction        'DENZO, SCALEPACK (Otwinowski, Minor, 1997)'
_computing_molecular_graphics    'Siemens SHELXTL-PLUS(VMS)'
_computing_publication_material  SHELXL-93
_computing_structure_refinement  'SHELXL-93 (Sheldrick, 1993)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1990)'
_diffrn_ambient_temperature      123(2)
_diffrn_detector_area_resol_mean '19 vertical, 18 horizontal'
_diffrn_measurement_device       Enraf-Nonius-KappaCCD
_diffrn_measurement_method
;
360 frames via ω-rotation (Δω\=1°) and two times 50s per frame
;
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0690
_diffrn_reflns_av_sigmaI/netI    0.0903
_diffrn_reflns_limit_h_max       0
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            14489
_diffrn_reflns_theta_max         22.66
_diffrn_reflns_theta_min         1.37
_exptl_absorpt_coefficient_mu    7.095
_exptl_absorpt_correction_T_max  0.2700
_exptl_absorpt_correction_T_min  0.2171
_exptl_absorpt_correction_type   SCALEPACK
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.185
_exptl_crystal_description       block
_exptl_crystal_F_000             4136
_exptl_crystal_size_max          0.31
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.25
_refine_diff_density_max         5.770
_refine_diff_density_min         -1.614
_refine_diff_density_rms         0.267
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.016
_refine_ls_goodness_of_fit_obs   1.118
_refine_ls_hydrogen_treatment    refU
_refine_ls_matrix_type           full
_refine_ls_number_parameters     762
_refine_ls_number_reflns         7816
_refine_ls_number_restraints     40
_refine_ls_restrained_S_all      1.123
_refine_ls_restrained_S_obs      1.115
_refine_ls_R_factor_all          0.1235
_refine_ls_R_factor_obs          0.0801
_refine_ls_shift/esd_max         0.908
_refine_ls_shift/esd_mean        0.025
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1214P)²+167.5607P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.2513
_refine_ls_wR_factor_obs         0.2023
_reflns_number_observed          5301
_reflns_number_total             7844
_reflns_observed_criterion       >2sigma(I)
_cod_data_source_file            ja9931325_8.cif
_cod_data_source_block           8a
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.1214P)^2^+167.5607P] where P=(Fo^2^+2Fc^2^)/3'
was changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.1214P)^2^+167.5607P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        6536.9(22)
_cod_database_code               4115928
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z'
'-x, -y, -z'
'x, -y-1/2, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_thermal_displace_type
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_group
Pt1 Pt 0.41352(7) 0.47898(4) 0.16600(4) 0.0383(3) Uani 1 d . .
Pt2 Pt 0.93093(7) 0.48805(4) 0.15582(5) 0.0428(3) Uani 1 d . .
Pt3 Pt 0.75005(7) 0.47443(4) 0.49919(5) 0.0482(4) Uani 1 d . .
Ag1 Ag 0.6369(2) 0.2500 -0.00459(14) 0.0487(8) Uani 1 d S .
Ag2 Ag 1.0494(2) 0.2500 0.3996(2) 0.0594(9) Uani 1 d S .
Ag3 Ag 0.4034(2) 0.2500 0.42017(13) 0.0457(7) Uani 1 d S .
Ag4 Ag 0.6542(7) 0.2797(5) 0.2845(5) 0.220(6) Uani 0.50 d P .
N11E N 0.4175(15) 0.5445(8) 0.0946(9) 0.048(6) Uani 1 d . .
H11A H 0.4730(15) 0.5610(8) 0.0995(9) 0.034(19) Uiso 1 calc R .
H11B H 0.4054(15) 0.5279(8) 0.0530(9) 0.034(19) Uiso 1 calc R .
N12E N 0.3410(13) 0.5409(8) 0.2077(10) 0.047(5) Uani 1 d . .
H12A H 0.2827(13) 0.5299(8) 0.2013(10) 0.034(19) Uiso 1 calc R .
H12B H 0.3605(13) 0.5431(8) 0.2525(10) 0.034(19) Uiso 1 calc R .
N21E N 0.9027(16) 0.5516(9) 0.0785(10) 0.057(6) Uani 1 d . .
H21A H 0.9323(16) 0.5422(9) 0.0441(10) 0.034(19) Uiso 1 calc R .
H21B H 0.8432(16) 0.5523(9) 0.0628(10) 0.034(19) Uiso 1 calc R .
N22E N 1.0022(15) 0.5551(9) 0.2068(11) 0.061(6) Uani 1 d . .
H22A H 0.9730(15) 0.5686(9) 0.2399(11) 0.034(19) Uiso 1 calc R .
H22B H 1.0562(15) 0.5407(9) 0.2261(11) 0.034(19) Uiso 1 calc R .
N31E N 0.8450(15) 0.5405(8) 0.5189(14) 0.072(8) Uani 1 d . .
N32E N 0.6661(15) 0.5409(10) 0.5205(11) 0.061(6) Uani 1 d . .
H32A H 0.6174(15) 0.5420(10) 0.4880(11) 0.034(19) Uiso 1 calc R .
H32B H 0.6473(15) 0.5325(10) 0.5600(11) 0.034(19) Uiso 1 calc R .
C11E C 0.3514(21) 0.5912(11) 0.1021(12) 0.059(8) Uani 1 d . .
H11C H 0.2923(21) 0.5787(11) 0.0797(12) 0.141(52) Uiso 1 calc R .
H11D H 0.3673(21) 0.6289(11) 0.0817(12) 0.141(52) Uiso 1 calc R .
C12E C 0.3503(21) 0.6005(11) 0.1766(14) 0.065(9) Uani 1 d . .
H12C H 0.4058(21) 0.6198(11) 0.1974(14) 0.141(52) Uiso 1 calc R .
H12D H 0.3003(21) 0.6265(11) 0.1831(14) 0.141(52) Uiso 1 calc R .
C21E C 0.9328(21) 0.6117(11) 0.1075(15) 0.065(8) Uani 1 d . .
H21C H 0.8847(21) 0.6296(11) 0.1281(15) 0.141(52) Uiso 1 calc R .
H21D H 0.9443(21) 0.6384(11) 0.0712(15) 0.141(52) Uiso 1 calc R .
C22E C 1.0156(18) 0.6079(11) 0.1591(13) 0.053(7) Uani 1 d . .
H22C H 1.0248(18) 0.6457(11) 0.1842(13) 0.141(52) Uiso 1 calc R .
H22D H 1.0679(18) 0.6005(11) 0.1373(13) 0.141(52) Uiso 1 calc R .
C31A C 0.7951(40) 0.6051(24) 0.5010(29) 0.054(15) Uiso 0.50 d P 1
C31B C 0.8038(42) 0.6037(26) 0.5446(30) 0.058(15) Uiso 0.50 d P 2
C32E C 0.7082(24) 0.5977(12) 0.5249(19) 0.090(11) Uani 1 d . .
N11 N 0.5609(16) 0.3324(8) 0.0441(10) 0.045(5) Uani 1 d . .
C12 C 0.6087(18) 0.3749(10) 0.0809(10) 0.038(7) Uani 1 d . .
C13 C 0.5674(21) 0.4161(10) 0.1174(11) 0.044(7) Uani 1 d . .
H13 H 0.6028(21) 0.4449(10) 0.1433(11) 0.059(18) Uiso 1 calc R .
N14 N 0.4768(15) 0.4167(8) 0.1171(9) 0.039(5) Uani 1 d . .
C15 C 0.4305(17) 0.3746(11) 0.0828(11) 0.042(6) Uani 1 d . .
H15 H 0.3689(17) 0.3714(11) 0.0831(11) 0.059(18) Uiso 1 calc R .
C16 C 0.4746(22) 0.3334(10) 0.0445(12) 0.049(7) Uani 1 d . .
H16 H 0.4392(22) 0.3052(10) 0.0178(12) 0.059(18) Uiso 1 calc R .
N11' N 0.7371(15) 0.3346(7) 0.0391(9) 0.037(5) Uani 1 d . .
C12' C 0.7068(16) 0.3752(10) 0.0775(11) 0.036(6) Uani 1 d . .
C13' C 0.7613(18) 0.4206(10) 0.1093(12) 0.040(6) Uani 1 d . .
H13' H 0.7372(18) 0.4489(10) 0.1359(12) 0.059(18) Uiso 1 calc R .
N14' N 0.8501(15) 0.4246(8) 0.1021(10) 0.044(5) Uani 1 d . .
C15' C 0.8824(19) 0.3833(12) 0.0600(12) 0.050(7) Uani 1 d . .
H15' H 0.9416(19) 0.3850(12) 0.0519(12) 0.059(18) Uiso 1 calc R .
C16' C 0.8233(20) 0.3392(10) 0.0303(11) 0.043(7) Uani 1 d . .
H16' H 0.8450(20) 0.3108(10) 0.0024(11) 0.059(18) Uiso 1 calc R .
N21 N 1.0282(16) 0.3341(9) 0.3233(9) 0.053(6) Uani 1 d . .
C22 C 0.9622(18) 0.3773(11) 0.3332(12) 0.051(7) Uani 1 d . .
C23 C 0.9369(17) 0.4215(10) 0.2869(13) 0.047(7) Uani 1 d . .
H23 H 0.8961(17) 0.4504(10) 0.2973(13) 0.059(18) Uiso 1 calc R .
N24 N 0.9662(12) 0.4265(7) 0.2273(10) 0.035(5) Uani 1 d . .
C25 C 1.0299(20) 0.3838(10) 0.2174(12) 0.054(8) Uani 1 d . .
H25 H 1.0558(20) 0.3855(10) 0.1782(12) 0.059(18) Uiso 1 calc R .
C26 C 1.0573(19) 0.3365(12) 0.2660(12) 0.054(7) Uiso 1 d . .
H26 H 1.0970(19) 0.3067(12) 0.2559(12) 0.059(18) Uiso 1 calc R .
N21' N 0.9699(17) 0.3334(10) 0.4444(10) 0.068(7) Uani 1 d . .
C22' C 0.9277(17) 0.3740(11) 0.3996(12) 0.044(6) Uiso 1 d . .
C23' C 0.8680(16) 0.4146(10) 0.4183(11) 0.037(6) Uiso 1 d . .
H23' H 0.8432(16) 0.4439(10) 0.3872(11) 0.059(18) Uiso 1 calc R .
N24' N 0.8440(13) 0.4139(8) 0.4790(10) 0.045(5) Uani 1 d . .
C25' C 0.8813(20) 0.3724(14) 0.5216(14) 0.066(8) Uiso 1 d . .
H25' H 0.8642(20) 0.3689(14) 0.5641(14) 0.059(18) Uiso 1 calc R .
C26' C 0.9456(22) 0.3339(15) 0.5036(16) 0.077(9) Uiso 1 d . .
H26' H 0.9733(22) 0.3066(15) 0.5358(16) 0.059(18) Uiso 1 calc R .
N31 N 0.5102(15) 0.3333(8) 0.4577(11) 0.056(6) Uani 1 d . .
C32 C 0.5222(16) 0.3725(10) 0.4098(11) 0.039(6) Uiso 1 d . .
C33 C 0.5967(17) 0.4111(11) 0.4216(12) 0.048(7) Uiso 1 d . .
H33 H 0.6078(17) 0.4378(11) 0.3879(12) 0.059(18) Uiso 1 calc R .
N34 N 0.6513(14) 0.4102(9) 0.4796(10) 0.048(5) Uani 1 d . .
C35 C 0.6365(18) 0.3709(12) 0.5251(13) 0.051(7) Uiso 1 d . .
H35 H 0.6761(18) 0.3688(12) 0.5658(13) 0.059(18) Uiso 1 calc R .
C36 C 0.5670(19) 0.3344(12) 0.5148(13) 0.054(7) Uiso 1 d . .
H36 H 0.5573(19) 0.3081(12) 0.5494(13) 0.059(18) Uiso 1 calc R .
N31' N 0.3912(14) 0.3331(9) 0.3410(9) 0.045(5) Uani 1 d . .
C32' C 0.4583(16) 0.3714(10) 0.3444(11) 0.039(6) Uiso 1 d . .
C33' C 0.4637(16) 0.4150(10) 0.2955(10) 0.037(6) Uiso 1 d . .
H33' H 0.5097(16) 0.4436(10) 0.3029(10) 0.059(18) Uiso 1 calc R .
N34' N 0.4051(13) 0.4174(7) 0.2381(9) 0.036(5) Uani 1 d . .
C35' C 0.3384(18) 0.3782(12) 0.2334(12) 0.050(7) Uiso 1 d . .
H35' H 0.2963(18) 0.3778(12) 0.1940(12) 0.059(18) Uiso 1 calc R .
C36' C 0.3283(19) 0.3383(12) 0.2834(12) 0.056(7) Uiso 1 d . .
H36' H 0.2773(19) 0.3137(12) 0.2786(12) 0.059(18) Uiso 1 calc R .
N10 N 1.6685(19) 0.5460(9) 0.0363(10) 0.048(6) Uani 1 d . .
O11 O 1.5895(14) 0.5286(8) 0.0330(9) 0.054(5) Uani 1 d . .
O12 O 1.7241(13) 0.5198(8) 0.0039(9) 0.057(5) Uani 1 d . .
O13 O 1.7009(13) 0.5905(9) 0.0742(9) 0.069(6) Uani 1 d . .
N20 N 0.7060(26) 0.4998(17) 0.2710(16) 0.119(11) Uiso 1 d D .
O21 O 0.7102(19) 0.5214(13) 0.2166(14) 0.122(9) Uiso 1 d D .
O22 O 0.7505(33) 0.5128(25) 0.3244(21) 0.248(22) Uiso 1 d D .
O23 O 0.6558(31) 0.4569(20) 0.2674(23) 0.231(20) Uiso 1 d D .
N30 N 0.1924(20) 0.4968(12) 0.3103(12) 0.134(16) Uani 1 d D .
O31 O 0.1806(14) 0.5461(13) 0.2782(11) 0.088(7) Uani 1 d D .
O32 O 0.2720(22) 0.4774(14) 0.3241(14) 0.131(10) Uiso 1 d D .
O33 O 0.1253(27) 0.4751(17) 0.3326(17) 0.161(14) Uiso 1 d D .
N40 N 0.7060(23) 0.2500 -0.1367(18) 0.268(44) Uiso 1 d SD .
O41 O 0.6235(20) 0.2500 -0.1304(15) 0.092(10) Uiso 1 d SD .
O42 O 0.7664(24) 0.2500 -0.0849(22) 0.192(22) Uiso 1 d SD .
O43 O 0.7295(34) 0.2500 -0.1948(21) 0.296(39) Uiso 1 d SD .
N50 N 0.4779(33) 0.2500 0.1957(23) 0.075(12) Uani 1 d S .
O51 O 0.4004(29) 0.2500 0.1629(21) 0.105(13) Uani 1 d S .
O52 O 0.5158(19) 0.2987(10) 0.2178(13) 0.114(9) Uani 1 d . .
N60 N 1.2361(20) 0.2500 0.4818(17) 0.102(18) Uani 1 d SD .
O61 O 1.1616(24) 0.2500 0.5064(19) 0.097(12) Uani 1 d SD .
O62 O 1.2262(17) 0.2500 0.4165(19) 0.069(9) Uani 1 d SD .
O63 O 1.3175(23) 0.2500 0.5141(20) 0.094(11) Uani 1 d SD .
N70 N 0.1240(14) 0.4767(10) 0.0849(11) 0.045(5) Uani 1 d . .
O71 O 0.1091(14) 0.5225(8) 0.0534(10) 0.069(6) Uani 1 d . .
O72 O 0.0886(11) 0.4254(7) 0.0640(8) 0.053(5) Uani 1 d . .
O73 O 0.1707(14) 0.4769(8) 0.1419(11) 0.069(6) Uani 1 d . .
N80 N 0.9539(26) 0.5742(18) 0.3977(18) 0.122(26) Uiso 0.50 d PD 1
O81 O 0.9841(38) 0.5302(21) 0.4288(28) 0.121(24) Uiso 0.50 d PD 1
O82 O 0.9848(39) 0.5906(28) 0.3489(24) 0.160(25) Uiso 0.50 d PD 1
O83 O 0.8963(35) 0.6038(24) 0.4177(26) 0.155(24) Uiso 0.50 d PD 1
O80A O 1.1300(47) 0.3947(34) 0.7077(32) 0.160(25) Uiso 0.50 d P 2
O80B O 0.9747(35) 0.5389(24) 0.3971(26) 0.082(14) Uiso 0.50 d P 2
N90 N 0.5070(14) 0.4367(11) 0.6228(11) 0.163(16) Uiso 1 d D .
O91 O 0.5666(18) 0.4169(13) 0.6640(12) 0.151(11) Uiso 1 d D .
O92 O 0.4329(17) 0.4150(20) 0.6177(20) 0.283(25) Uiso 1 d D .
O93 O 0.5234(18) 0.4736(11) 0.5823(12) 0.126(10) Uiso 1 d D .
N100 N 0.7258(55) 0.2500 0.4278(36) 0.193(29) Uiso 1 d SD .
O101 O 0.7591(45) 0.2500 0.4885(35) 0.222(27) Uiso 1 d SD .
O102 O 0.7252(43) 0.3018(21) 0.4007(25) 0.303(29) Uiso 1 d D .
N110 N 0.8138(27) 0.2500 0.1994(24) 0.258(46) Uiso 1 d SD .
O111 O 0.7324(27) 0.2500 0.1857(35) 0.277(35) Uiso 1 d SD .
O112 O 0.8578(25) 0.2064(16) 0.1890(30) 0.093(17) Uiso 0.50 d PD .
O113 O 0.8514(36) 0.2975(16) 0.2174(47) 0.327(69) Uiso 0.50 d PD .
O1W O 0.2222(12) 0.3367(7) 0.0801(8) 0.054(5) Uani 1 d . .
O2W O 0.1811(16) 0.2500 0.1769(12) 0.055(7) Uani 1 d S .
O3W O 0.1861(20) 0.2500 -0.0210(14) 0.071(8) Uani 1 d S .
O4W O 0.5651(13) 0.6321(8) 0.1441(10) 0.072(6) Uani 1 d . .
O5W O 0.2141(16) 0.6614(10) 0.3376(9) 0.092(7) Uani 1 d . .
O6W O 0.5829(23) 0.7500 0.0934(13) 0.084(9) Uani 1 d S .
O7W O 1.0040(21) 0.2500 -0.0170(15) 0.090(10) Uani 1 d S .
O8W O 0.9056(33) 0.2500 -0.1497(16) 0.135(18) Uani 1 d S .
O9W O 0.3561(25) 0.7500 0.3479(15) 0.103(11) Uani 1 d S .
O10W O 0.7581(25) 0.7500 0.1454(17) 0.118(13) Uani 1 d S .
O11W O 0.4858(27) 0.7500 0.2627(16) 0.117(13) Uani 1 d S .
O12W O 0.0050(21) 0.2500 0.1216(17) 0.108(12) Uani 1 d S .
O13W O 0.5987(18) 0.6507(14) 0.2777(11) 0.122(10) Uani 1 d . .
O14W O 0.0942(28) 0.7500 0.2873(22) 0.145(16) Uani 1 d S .
O15W O 0.9502(40) 0.7500 0.3521(27) 0.195(23) Uiso 1 d S .
O16W O 0.2007(36) 0.3639(24) 0.7687(25) 0.113(17) Uiso 0.50 d P .
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'
Pt Pt -1.7033 8.3905 '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'
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
N34' Pt1 N14 88.7(7) . .
N34' Pt1 N12E 93.5(8) . .
N14 Pt1 N12E 174.8(8) . .
N34' Pt1 N11E 177.1(8) . .
N14 Pt1 N11E 94.2(8) . .
N12E Pt1 N11E 83.6(8) . .
N24 Pt2 N22E 94.2(8) . .
N24 Pt2 N14' 89.0(7) . .
N22E Pt2 N14' 175.4(9) . .
N24 Pt2 N21E 175.9(8) . .
N22E Pt2 N21E 85.1(9) . .
N14' Pt2 N21E 91.9(8) . .
N32E Pt3 N24' 174.4(8) . .
N32E Pt3 N31E 83.3(9) . .
N24' Pt3 N31E 91.1(8) . .
N32E Pt3 N34 94.7(9) . .
N24' Pt3 N34 90.9(8) . .
N31E Pt3 N34 178.0(8) . .
N11 Ag1 N11 96.6(10) . 4_565
N11 Ag1 N11' 66.0(7) . .
N11 Ag1 N11' 136.1(7) 4_565 .
N11 Ag1 N11' 136.1(7) . 4_565
N11 Ag1 N11' 66.0(7) 4_565 4_565
N11' Ag1 N11' 98.0(9) . 4_565
N11 Ag1 O41 115.9(6) . .
N11 Ag1 O41 115.9(6) 4_565 .
N11' Ag1 O41 107.8(6) . .
N11' Ag1 O41 107.8(6) 4_565 .
N21 Ag2 N21 101.6(9) 4_565 .
N21 Ag2 N21' 68.2(6) 4_565 4_565
N21 Ag2 N21' 142.7(9) . 4_565
N21 Ag2 N21' 142.7(9) 4_565 .
N21 Ag2 N21' 68.2(6) . .
N21' Ag2 N21' 97.7(11) 4_565 .
N21 Ag2 O61 123.3(6) 4_565 .
N21 Ag2 O61 123.3(6) . .
N21' Ag2 O61 89.4(8) 4_565 .
N21' Ag2 O61 89.4(8) . .
N31' Ag3 N31' 98.8(8) 4_565 .
N31' Ag3 O63 120.8(7) 4_565 1_455
N31' Ag3 O63 120.8(6) . 1_455
N31' Ag3 N31 137.8(7) 4_565 .
N31' Ag3 N31 67.4(6) . .
O63 Ag3 N31 99.4(8) 1_455 .
N31' Ag3 N31 67.4(6) 4_565 4_565
N31' Ag3 N31 137.8(7) . 4_565
O63 Ag3 N31 99.4(8) 1_455 4_565
N31 Ag3 N31 95.6(9) . 4_565
Ag4 Ag4 O52 100.4(7) 4_565 .
Ag4 Ag4 O102 101.5(10) 4_565 .
O52 Ag4 O102 136.5(17) . .
Ag4 Ag4 O111 75.1(5) 4_565 .
O52 Ag4 O111 94.7(14) . .
O102 Ag4 O111 127.1(19) . .
C11E N11E Pt1 109.4(15) . .
C12E N12E Pt1 109.6(15) . .
C21E N21E Pt2 107.1(17) . .
C22E N22E Pt2 110.6(16) . .
C31A N31E Pt3 107.4(24) . .
C31B N31E Pt3 112.3(25) . .
C32E N32E Pt3 111.7(20) . .
N11E C11E C12E 108.1(21) . .
N12E C12E C11E 108.5(21) . .
N21E C21E C22E 113.0(23) . .
C21E C22E N22E 107.2(21) . .
C32E C31A N31E 103.6(36) . .
C32E C31B N31E 104.4(38) . .
N32E C32E C31B 121.5(31) . .
N32E C32E C31A 119.7(31) . .
C16 N11 C12 115.9(22) . .
C16 N11 Ag1 123.4(16) . .
C12 N11 Ag1 120.0(18) . .
N11 C12 C13 120.6(25) . .
N11 C12 C12' 115.6(22) . .
C13 C12 C12' 123.8(22) . .
N14 C13 C12 122.7(23) . .
C15 N14 C13 116.8(20) . .
C15 N14 Pt1 119.5(18) . .
C13 N14 Pt1 123.7(15) . .
N14 C15 C16 119.2(24) . .
N11 C16 C15 124.6(23) . .
C12' N11' C16' 117.4(20) . .
C12' N11' Ag1 118.4(16) . .
C16' N11' Ag1 124.0(14) . .
N11' C12' C13' 122.0(23) . .
N11' C12' C12 117.6(21) . .
C13' C12' C12 120.2(22) . .
N14' C13' C12' 121.0(23) . .
C13' N14' C15' 117.7(21) . .
C13' N14' Pt2 119.9(16) . .
C15' N14' Pt2 122.3(19) . .
N14' C15' C16' 117.4(24) . .
N11' C16' C15' 124.4(22) . .
C26 N21 C22 116.2(22) . .
C26 N21 Ag2 124.7(17) . .
C22 N21 Ag2 117.3(14) . .
C23 C22 N21 121.1(24) . .
C23 C22 C22' 122.7(25) . .
N21 C22 C22' 116.0(20) . .
N24 C23 C22 124.8(24) . .
C23 N24 C25 113.9(20) . .
C23 N24 Pt2 127.7(15) . .
C25 N24 Pt2 118.3(16) . .
N24 C25 C26 121.8(22) . .
N21 C26 C25 121.9(25) . .
C26' N21' C22' 115.6(25) . .
C26' N21' Ag2 124.6(20) . .
C22' N21' Ag2 117.3(15) . .
N21' C22' C23' 120.9(22) . .
N21' C22' C22 115.4(22) . .
C23' C22' C22 123.0(22) . .
N24' C23' C22' 122.1(22) . .
C25' N24' C23' 117.0(22) . .
C25' N24' Pt3 124.6(19) . .
C23' N24' Pt3 118.4(16) . .
N24' C25' C26' 120.3(28) . .
N21' C26' C25' 123.8(31) . .
C36 N31 C32 118.3(23) . .
C36 N31 Ag3 125.4(16) . .
C32 N31 Ag3 114.8(16) . .
N31 C32 C33 118.2(22) . .
N31 C32 C32' 118.8(22) . .
C33 C32 C32' 123.0(21) . .
N34 C33 C32 120.9(23) . .
C35 N34 C33 118.6(23) . .
C35 N34 Pt3 121.6(17) . .
C33 N34 Pt3 119.6(17) . .
N34 C35 C36 121.2(25) . .
N31 C36 C35 122.8(25) . .
C32' N31' C36' 114.4(20) . .
C32' N31' Ag3 118.5(16) . .
C36' N31' Ag3 125.8(15) . .
N31' C32' C33' 122.8(22) . .
N31' C32' C32 116.0(20) . .
C33' C32' C32 120.5(22) . .
N34' C33' C32' 122.2(22) . .
C35' N34' C33' 115.3(19) . .
C35' N34' Pt1 121.8(16) . .
C33' N34' Pt1 122.8(15) . .
N34' C35' C36' 123.0(25) . .
C35' C36' N31' 121.9(26) . .
O11 N10 O12 122.2(21) . .
O11 N10 O13 122.4(22) . .
O12 N10 O13 115.3(25) . .
O21 N20 O23 112.4(41) . .
O21 N20 O22 127.6(47) . .
O23 N20 O22 119.7(44) . .
O31 N30 O33 116.8(29) . .
O31 N30 O32 117.2(29) . .
O33 N30 O32 125.4(32) . .
O42 N40 O41 120.4(17) . .
O42 N40 O43 118.9(17) . .
O41 N40 O43 120.7(17) . .
N40 O41 Ag1 100.1(18) . .
O51 N50 O52 121.3(24) . .
O51 N50 O52 121.3(24) . 4_565
O52 N50 O52 116.4(48) . 4_565
N50 O52 Ag4 111.2(27) . .
O63 N60 O61 128.2(34) . .
O63 N60 O62 117.1(29) . .
O61 N60 O62 114.7(30) . .
N60 O61 Ag2 100.5(24) . .
N60 O63 Ag3 100.8(24) . 1_655
O71 N70 O73 121.1(23) . .
O71 N70 O72 122.4(22) . .
O73 N70 O72 116.4(21) . .
O82 N80 O81 120.1(8) . .
O82 N80 O83 119.9(8) . .
O81 N80 O83 119.9(8) . .
O91 N90 O93 120.0(5) . .
O91 N90 O92 119.7(5) . .
O93 N90 O92 119.8(5) . .
O101 N100 O102 113.3(45) . 4_565
O101 N100 O102 113.3(45) . .
O102 N100 O102 129.2(89) 4_565 .
N100 O102 Ag4 101.6(51) . .
O111 N110 O112 121.6(21) . .
O111 N110 O112 121.6(21) . 4_565
O112 N110 O112 106.0(50) . 4_565
O111 N110 O113 118.2(20) . 4_565
O112 N110 O113 28.6(60) . 4_565
O112 N110 O113 119.7(22) 4_565 4_565
O111 N110 O113 118.2(20) . .
O112 N110 O113 119.7(22) . .
O112 N110 O113 28.6(60) 4_565 .
O113 N110 O113 118.6(62) 4_565 .
N110 O111 Ag4 113.5(43) . .
N110 O111 Ag4 113.5(43) . 4_565
Ag4 O111 Ag4 29.8(9) . 4_565
O113 O112 N110 77.0(39) 4_565 .
O112 O113 N110 74.4(40) 4_565 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pt1 N34' 2.00(2) .
Pt1 N14 2.01(2) .
Pt1 N12E 2.01(2) .
Pt1 N11E 2.04(2) .
Pt2 N24 1.98(2) .
Pt2 N22E 2.00(2) .
Pt2 N14' 2.04(2) .
Pt2 N21E 2.08(2) .
Pt3 N32E 2.02(2) .
Pt3 N24' 2.03(2) .
Pt3 N31E 2.03(2) .
Pt3 N34 2.04(2) .
Ag1 N11 2.43(2) .
Ag1 N11 2.43(2) 4_565
Ag1 N11' 2.47(2) .
Ag1 N11' 2.47(2) 4_565
Ag1 O41 2.49(3) .
Ag2 N21 2.39(2) 4_565
Ag2 N21 2.39(2) .
Ag2 N21' 2.44(2) 4_565
Ag2 N21' 2.44(2) .
Ag2 O61 2.51(4) .
Ag3 N31' 2.41(2) 4_565
Ag3 N31' 2.41(2) .
Ag3 O63 2.44(4) 1_455
Ag3 N31 2.47(2) .
Ag3 N31 2.47(2) 4_565
Ag4 Ag4 1.31(2) 4_565
Ag4 O52 2.33(3) .
Ag4 O102 2.45(5) .
Ag4 O111 2.54(6) .
N11E C11E 1.45(3) .
N12E C12E 1.47(3) .
N21E C21E 1.49(3) .
N22E C22E 1.54(3) .
N31E C31A 1.62(6) .
N31E C31B 1.64(6) .
N32E C32E 1.40(4) .
C11E C12E 1.51(3) .
C21E C22E 1.49(4) .
C31A C32E 1.47(7) .
C31B C32E 1.43(7) .
N11 C16 1.30(3) .
N11 C12 1.33(3) .
C12 C13 1.37(3) .
C12 C12' 1.49(3) .
C13 N14 1.36(3) .
N14 C15 1.29(3) .
C15 C16 1.42(3) .
N11' C12' 1.31(3) .
N11' C16' 1.34(3) .
C12' C13' 1.38(3) .
C13' N14' 1.37(3) .
N14' C15' 1.38(3) .
C15' C16' 1.39(3) .
N21 C26 1.29(3) .
N21 C22 1.41(3) .
C22 C23 1.35(3) .
C22 C22' 1.50(3) .
C23 N24 1.34(3) .
N24 C25 1.38(3) .
C25 C26 1.44(3) .
N21' C26' 1.29(3) .
N21' C22' 1.35(3) .
C22' C23' 1.36(3) .
C23' N24' 1.32(3) .
N24' C25' 1.31(3) .
C25' C26' 1.37(4) .
N31 C36 1.32(3) .
N31 C32 1.32(3) .
C32 C33 1.40(3) .
C32 C32' 1.50(3) .
C33 N34 1.31(3) .
N34 C35 1.30(3) .
C35 C36 1.31(3) .
N31' C32' 1.31(3) .
N31' C36' 1.38(3) .
C32' C33' 1.38(3) .
C33' N34' 1.33(3) .
N34' C35' 1.31(3) .
C35' C36' 1.36(3) .
N10 O11 1.24(3) .
N10 O12 1.27(3) .
N10 O13 1.29(3) .
N20 O21 1.198(10) .
N20 O23 1.202(10) .
N20 O22 1.205(10) .
N30 O31 1.26(2) .
N30 O33 1.26(2) .
N30 O32 1.26(2) .
N40 O42 1.27(2) .
N40 O41 1.27(2) .
N40 O43 1.27(2) .
N50 O51 1.24(5) .
N50 O52 1.26(3) .
N50 O52 1.26(3) 4_565
N60 O63 1.29(2) .
N60 O61 1.29(2) .
N60 O62 1.29(2) .
O63 Ag3 2.44(4) 1_655
N70 O71 1.19(2) .
N70 O73 1.24(2) .
N70 O72 1.29(3) .
N80 O82 1.200(10) .
N80 O81 1.201(10) .
N80 O83 1.202(10) .
O80A O16W 1.63(8) 1_655
N90 O91 1.200(5) .
N90 O93 1.200(5) .
N90 O92 1.202(5) .
N100 O101 1.24(2) .
N100 O102 1.26(2) 4_565
N100 O102 1.26(2) .
N110 O111 1.21(2) .
N110 O112 1.20(2) .
N110 O112 1.20(2) 4_565
N110 O113 1.22(2) 4_565
N110 O113 1.22(2) .
O111 Ag4 2.54(6) 4_565
O112 O113 0.60(12) 4_565
O113 O112 0.60(12) 4_565
O16W O80A 1.63(8) 1_455
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
N34' Pt1 N11E C11E -6.4(161) . .
N14 Pt1 N11E C11E 161.6(17) . .
N12E Pt1 N11E C11E -13.7(17) . .
N34' Pt1 N12E C12E 166.3(19) . .
N14 Pt1 N12E C12E -79.4(92) . .
N11E Pt1 N12E C12E -14.1(19) . .
N24 Pt2 N21E C21E -91.9(109) . .
N22E Pt2 N21E C21E -11.3(18) . .
N14' Pt2 N21E C21E 165.2(18) . .
N24 Pt2 N22E C22E 163.0(16) . .
N14' Pt2 N22E C22E -61.7(115) . .
N21E Pt2 N22E C22E -12.9(17) . .
N32E Pt3 N31E C31A -28.1(26) . .
N24' Pt3 N31E C31A 151.6(26) . .
N34 Pt3 N31E C31A -19.4(279) . .
N32E Pt3 N31E C31B 4.2(28) . .
N24' Pt3 N31E C31B -176.1(28) . .
N34 Pt3 N31E C31B 12.9(280) . .
N24' Pt3 N32E C32E 7.5(99) . .
N31E Pt3 N32E C32E 10.9(22) . .
N34 Pt3 N32E C32E -168.8(22) . .
Pt1 N11E C11E C12E 37.8(25) . .
Pt1 N12E C12E C11E 38.4(27) . .
N11E C11E C12E N12E -50.5(30) . .
Pt2 N21E C21E C22E 35.2(27) . .
N21E C21E C22E N22E -46.3(30) . .
Pt2 N22E C22E C21E 34.5(24) . .
C31B N31E C31A C32E -65.5(57) . .
Pt3 N31E C31A C32E 39.1(40) . .
C31A N31E C31B C32E 69.1(60) . .
Pt3 N31E C31B C32E -17.5(45) . .
Pt3 N32E C32E C31B -27.9(48) . .
Pt3 N32E C32E C31A 12.4(46) . .
N31E C31B C32E N32E 29.6(56) . .
N31E C31B C32E C31A -68.2(54) . .
N31E C31A C32E N32E -34.2(52) . .
N31E C31A C32E C31B 69.2(55) . .
N11 Ag1 N11 C16 -45.1(22) 4_565 .
N11' Ag1 N11 C16 177.0(21) . .
N11' Ag1 N11 C16 -107.1(20) 4_565 .
O41 Ag1 N11 C16 78.0(21) . .
N11 Ag1 N11 C12 125.0(15) 4_565 .
N11' Ag1 N11 C12 -12.9(15) . .
N11' Ag1 N11 C12 63.0(20) 4_565 .
O41 Ag1 N11 C12 -111.9(17) . .
C16 N11 C12 C13 1.1(31) . .
Ag1 N11 C12 C13 -169.7(15) . .
C16 N11 C12 C12' -177.2(19) . .
Ag1 N11 C12 C12' 12.0(24) . .
N11 C12 C13 N14 -1.3(33) . .
C12' C12 C13 N14 176.9(19) . .
C12 C13 N14 C15 2.8(32) . .
C12 C13 N14 Pt1 -176.7(15) . .
N34' Pt1 N14 C15 78.0(19) . .
N12E Pt1 N14 C15 -36.5(97) . .
N11E Pt1 N14 C15 -101.4(18) . .
N34' Pt1 N14 C13 -102.5(18) . .
N12E Pt1 N14 C13 142.9(83) . .
N11E Pt1 N14 C13 78.1(18) . .
C13 N14 C15 C16 -3.9(33) . .
Pt1 N14 C15 C16 175.5(17) . .
C12 N11 C16 C15 -2.5(35) . .
Ag1 N11 C16 C15 168.0(18) . .
N14 C15 C16 N11 4.2(38) . .
N11 Ag1 N11' C12' 13.0(15) . .
N11 Ag1 N11' C12' -60.8(20) 4_565 .
N11' Ag1 N11' C12' -124.3(15) 4_565 .
O41 Ag1 N11' C12' 124.0(16) . .
N11 Ag1 N11' C16' -172.5(19) . .
N11 Ag1 N11' C16' 113.8(18) 4_565 .
N11' Ag1 N11' C16' 50.3(20) 4_565 .
O41 Ag1 N11' C16' -61.4(18) . .
C16' N11' C12' C13' -1.2(32) . .
Ag1 N11' C12' C13' 173.7(15) . .
C16' N11' C12' C12 172.8(18) . .
Ag1 N11' C12' C12 -12.3(25) . .
N11 C12 C12' N11' 0.4(28) . .
C13 C12 C12' N11' -177.8(20) . .
N11 C12 C12' C13' 174.6(19) . .
C13 C12 C12' C13' -3.6(32) . .
N11' C12' C13' N14' -0.5(33) . .
C12 C12' C13' N14' -174.5(19) . .
C12' C13' N14' C15' 2.5(31) . .
C12' C13' N14' Pt2 -175.1(15) . .
N24 Pt2 N14' C13' 92.9(17) . .
N22E Pt2 N14' C13' -42.5(116) . .
N21E Pt2 N14' C13' -91.1(17) . .
N24 Pt2 N14' C15' -84.6(18) . .
N22E Pt2 N14' C15' 140.0(106) . .
N21E Pt2 N14' C15' 91.4(18) . .
C13' N14' C15' C16' -2.7(31) . .
Pt2 N14' C15' C16' 174.9(16) . .
C12' N11' C16' C15' 1.0(34) . .
Ag1 N11' C16' C15' -173.6(17) . .
N14' C15' C16' N11' 1.0(35) . .
N21 Ag2 N21 C26 -39.5(27) 4_565 .
N21' Ag2 N21 C26 -108.5(23) 4_565 .
N21' Ag2 N21 C26 178.1(24) . .
O61 Ag2 N21 C26 104.2(22) . .
N21 Ag2 N21 C22 124.6(14) 4_565 .
N21' Ag2 N21 C22 55.5(21) 4_565 .
N21' Ag2 N21 C22 -17.8(17) . .
O61 Ag2 N21 C22 -91.7(20) . .
C26 N21 C22 C23 -5.1(35) . .
Ag2 N21 C22 C23 -170.5(18) . .
C26 N21 C22 C22' 179.2(22) . .
Ag2 N21 C22 C22' 13.8(27) . .
N21 C22 C23 N24 4.2(38) . .
C22' C22 C23 N24 179.6(22) . .
C22 C23 N24 C25 -3.1(34) . .
C22 C23 N24 Pt2 178.4(18) . .
N22E Pt2 N24 C23 74.3(20) . .
N14' Pt2 N24 C23 -102.5(20) . .
N21E Pt2 N24 C23 154.5(101) . .
N22E Pt2 N24 C25 -104.1(18) . .
N14' Pt2 N24 C25 79.1(18) . .
N21E Pt2 N24 C25 -23.8(115) . .
C23 N24 C25 C26 3.2(34) . .
Pt2 N24 C25 C26 -178.2(19) . .
C22 N21 C26 C25 5.3(37) . .
Ag2 N21 C26 C25 169.5(19) . .
N24 C25 C26 N21 -4.7(41) . .
N21 Ag2 N21' C26' 102.9(26) 4_565 .
N21 Ag2 N21' C26' -176.8(28) . .
N21' Ag2 N21' C26' 39.0(30) 4_565 .
O61 Ag2 N21' C26' -50.3(26) . .
N21 Ag2 N21' C22' -58.7(24) 4_565 .
N21 Ag2 N21' C22' 21.6(19) . .
N21' Ag2 N21' C22' -122.6(17) 4_565 .
O61 Ag2 N21' C22' 148.2(21) . .
C26' N21' C22' C23' 4.0(40) . .
Ag2 N21' C22' C23' 167.2(18) . .
C26' N21' C22' C22 174.4(25) . .
Ag2 N21' C22' C22 -22.3(29) . .
C23 C22 C22' N21' -169.8(24) . .
N21 C22 C22' N21' 5.8(32) . .
C23 C22 C22' C23' 0.4(38) . .
N21 C22 C22' C23' 176.1(23) . .
N21' C22' C23' N24' -4.6(38) . .
C22 C22' C23' N24' -174.3(22) . .
C22' C23' N24' C25' 0.8(35) . .
C22' C23' N24' Pt3 -177.2(18) . .
N32E Pt3 N24' C25' 103.6(88) . .
N31E Pt3 N24' C25' 100.3(22) . .
N34 Pt3 N24' C25' -80.1(22) . .
N32E Pt3 N24' C23' -78.6(90) . .
N31E Pt3 N24' C23' -81.9(18) . .
N34 Pt3 N24' C23' 97.8(17) . .
C23' N24' C25' C26' 3.2(39) . .
Pt3 N24' C25' C26' -179.0(21) . .
C22' N21' C26' C25' 0.1(46) . .
Ag2 N21' C26' C25' -161.8(24) . .
N24' C25' C26' N21' -3.8(49) . .
N31' Ag3 N31 C36 -103.6(22) 4_565 .
N31' Ag3 N31 C36 178.6(23) . .
O63 Ag3 N31 C36 59.0(22) 1_455 .
N31 Ag3 N31 C36 -41.4(24) 4_565 .
N31' Ag3 N31 C32 61.9(20) 4_565 .
N31' Ag3 N31 C32 -15.9(16) . .
O63 Ag3 N31 C32 -135.4(18) 1_455 .
N31 Ag3 N31 C32 124.1(15) 4_565 .
C36 N31 C32 C33 2.6(34) . .
Ag3 N31 C32 C33 -164.0(17) . .
C36 N31 C32 C32' 179.6(22) . .
Ag3 N31 C32 C32' 13.0(27) . .
N31 C32 C33 N34 -2.7(35) . .
C32' C32 C33 N34 -179.5(22) . .
C32 C33 N34 C35 2.5(35) . .
C32 C33 N34 Pt3 -172.4(17) . .
N32E Pt3 N34 C35 -97.4(20) . .
N24' Pt3 N34 C35 83.0(20) . .
N31E Pt3 N34 C35 -106.0(266) . .
N32E Pt3 N34 C33 77.4(19) . .
N24' Pt3 N34 C33 -102.3(19) . .
N31E Pt3 N34 C33 68.8(269) . .
C33 N34 C35 C36 -2.5(37) . .
Pt3 N34 C35 C36 172.3(19) . .
C32 N31 C36 C35 -2.7(39) . .
Ag3 N31 C36 C35 162.4(20) . .
N34 C35 C36 N31 2.6(42) . .
N31' Ag3 N31' C32' -119.6(15) 4_565 .
O63 Ag3 N31' C32' 106.4(19) 1_455 .
N31 Ag3 N31' C32' 18.8(16) . .
N31 Ag3 N31' C32' -53.6(20) 4_565 .
N31' Ag3 N31' C36' 46.7(23) 4_565 .
O63 Ag3 N31' C36' -87.4(21) 1_455 .
N31 Ag3 N31' C36' -174.9(22) . .
N31 Ag3 N31' C36' 112.6(20) 4_565 .
C36' N31' C32' C33' 2.5(33) . .
Ag3 N31' C32' C33' 170.2(17) . .
C36' N31' C32' C32 172.8(21) . .
Ag3 N31' C32' C32 -19.5(26) . .
N31 C32 C32' N31' 3.7(32) . .
C33 C32 C32' N31' -179.5(22) . .
N31 C32 C32' C33' 174.3(22) . .
C33 C32 C32' C33' -8.9(35) . .
N31' C32' C33' N34' -6.6(36) . .
C32 C32' C33' N34' -176.5(21) . .
C32' C33' N34' C35' 4.6(32) . .
C32' C33' N34' Pt1 -178.6(17) . .
N14 Pt1 N34' C35' -86.2(18) . .
N12E Pt1 N34' C35' 89.1(18) . .
N11E Pt1 N34' C35' 81.8(155) . .
N14 Pt1 N34' C33' 97.2(18) . .
N12E Pt1 N34' C33' -87.5(18) . .
N11E Pt1 N34' C33' -94.8(154) . .
C33' N34' C35' C36' 0.8(35) . .
Pt1 N34' C35' C36' -176.0(19) . .
N34' C35' C36' N31' -4.8(40) . .
C32' N31' C36' C35' 2.9(35) . .
Ag3 N31' C36' C35' -163.8(19) . .
O42 N40 O41 Ag1 0.000(1) . .
O43 N40 O41 Ag1 180.000(3) . .
N11 Ag1 O41 N40 123.9(7) . .
N11 Ag1 O41 N40 -123.9(7) 4_565 .
N11' Ag1 O41 N40 52.4(5) . .
N11' Ag1 O41 N40 -52.4(5) 4_565 .
O51 N50 O52 Ag4 175.0(35) . .
O52 N50 O52 Ag4 6.2(49) 4_565 .
Ag4 Ag4 O52 N50 -3.3(26) 4_565 .
O102 Ag4 O52 N50 -122.5(27) . .
O111 Ag4 O52 N50 72.4(26) . .
O63 N60 O61 Ag2 180.000(7) . .
O62 N60 O61 Ag2 0.000(6) . .
N21 Ag2 O61 N60 68.0(7) 4_565 .
N21 Ag2 O61 N60 -68.0(7) . .
N21' Ag2 O61 N60 131.1(5) 4_565 .
N21' Ag2 O61 N60 -131.1(5) . .
O61 N60 O63 Ag3 180.000(4) . 1_655
O62 N60 O63 Ag3 0.000(3) . 1_655
O101 N100 O102 Ag4 -179.5(63) . .
O102 N100 O102 Ag4 25.1(142) 4_565 .
Ag4 Ag4 O102 N100 -10.7(63) 4_565 .
O52 Ag4 O102 N100 108.1(61) . .
O111 Ag4 O102 N100 -90.6(60) . .
O112 N110 O111 Ag4 126.6(47) . .
O112 N110 O111 Ag4 -94.0(54) 4_565 .
O113 N110 O111 Ag4 93.7(60) 4_565 .
O113 N110 O111 Ag4 -61.1(64) . .
O112 N110 O111 Ag4 94.0(54) . 4_565
O112 N110 O111 Ag4 -126.6(46) 4_565 4_565
O113 N110 O111 Ag4 61.1(64) 4_565 4_565
O113 N110 O111 Ag4 -93.7(60) . 4_565
Ag4 Ag4 O111 N110 -96.6(15) 4_565 .
O52 Ag4 O111 N110 163.8(14) . .
O102 Ag4 O111 N110 -3.4(21) . .
Ag4 Ag4 O111 Ag4 0.000(8) 4_565 4_565
O52 Ag4 O111 Ag4 -99.5(8) . 4_565
O102 Ag4 O111 Ag4 93.2(13) . 4_565
O111 N110 O112 O113 -91.8(77) . 4_565
O112 N110 O112 O113 123.4(76) 4_565 4_565
O113 N110 O112 O113 0.00(3) 4_565 4_565
O113 N110 O112 O113 96.0(115) . 4_565
O111 N110 O113 O112 -105.0(66) . 4_565
O112 N110 O113 O112 67.5(95) . 4_565
O112 N110 O113 O112 0.00(2) 4_565 4_565
O113 N110 O113 O112 100.3(115) 4_565 4_565
