#------------------------------------------------------------------------------
#$Date: 2023-09-05 22:13:17 +0300 (Tue, 05 Sep 2023) $
#$Revision: 286052 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/94/1569455.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_1569455
loop_
_publ_author_name
'Jiang, Lirong'
'Jing, Mengmeng'
'Yin, Bing'
'Du, Wenjun'
'Wang, Xiaojian'
'Liu, Ying'
'Chen, Shuang'
'Zhu, Manzhou'
_publ_section_title
;
 Bright near-infrared circularly polarized electrochemiluminescence from
 Au₉Ag₄ nanoclusters.
;
_journal_issue                   26
_journal_name_full               'Chemical science'
_journal_page_first              7304
_journal_page_last               7309
_journal_paper_doi               10.1039/d3sc01329d
_journal_volume                  14
_journal_year                    2023
_chemical_formula_moiety         'C112 H112 Ag4 Au9 Cl4 P8, C H2 Cl2, Cl'
_chemical_formula_sum            'C113 H114 Ag4 Au9 Cl7 P8'
_chemical_formula_weight         4172.12
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_date             2020-12-24
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2022-04-11 deposited with the CCDC.	2023-06-06 downloaded from the CCDC.
;
_cell_angle_alpha                110.163(2)
_cell_angle_beta                 103.825(2)
_cell_angle_gamma                105.043(2)
_cell_formula_units_Z            2
_cell_length_a                   17.8906(4)
_cell_length_b                   21.6153(5)
_cell_length_c                   23.3885(5)
_cell_measurement_reflns_used    71019
_cell_measurement_temperature    120
_cell_measurement_theta_max      70.17
_cell_measurement_theta_min      4.22
_cell_volume                     7642.4(4)
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      120
_diffrn_measured_fraction_theta_full 0.959
_diffrn_measured_fraction_theta_max 0.937
_diffrn_measurement_device_type  STADIVARI
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54186
_diffrn_reflns_av_R_equivalents  0.0466
_diffrn_reflns_av_unetI/netI     0.0430
_diffrn_reflns_Laue_measured_fraction_full 0.959
_diffrn_reflns_Laue_measured_fraction_max 0.937
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            56056
_diffrn_reflns_point_group_measured_fraction_full 0.959
_diffrn_reflns_point_group_measured_fraction_max 0.937
_diffrn_reflns_theta_full        67.686
_diffrn_reflns_theta_max         69.763
_diffrn_reflns_theta_min         4.231
_exptl_absorpt_coefficient_mu    21.979
_exptl_crystal_density_diffrn    1.813
_exptl_crystal_description       block
_exptl_crystal_F_000             3860
_refine_diff_density_max         6.842
_refine_diff_density_min         -4.637
_refine_diff_density_rms         0.456
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.037
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1270
_refine_ls_number_reflns         27060
_refine_ls_number_restraints     45
_refine_ls_restrained_S_all      1.039
_refine_ls_R_factor_all          0.0992
_refine_ls_R_factor_gt           0.0882
_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)+(0.1960P)²+103.9494P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2493
_refine_ls_wR_factor_ref         0.2690
_reflns_Friedel_coverage         0.000
_reflns_number_gt                22767
_reflns_number_total             27060
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d3sc01329d2.cif
_cod_data_source_block           1_sq_s
_cod_depositor_comments          'Adding full bibliography for 1569455.cif.'
_cod_original_cell_volume        7642.4(3)
_cod_database_code               1569455
_shelx_shelxl_version_number     2016/4
_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.
;
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2. Restrained distances
 Cl1-C47 = Cl0M-C47
 1.65 with sigma of 0.01
 Ag0C-Cl3
 2.552 with sigma of 0.01
3. Uiso/Uaniso restraints and constraints
C43 \\sim C03L \\sim C02V \\sim C03T \\sim C86 \\sim C131: within 1.7A with
sigma of 0.004 and sigma for terminal atoms of 0.008
Uanis(Cl3) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
4.a Secondary CH2 refined with riding coordinates:
 C011(H01A,H01B), C014(H01C,H01D), C016(H01E,H01F), C019(H01G,H01H), C01C(H01J,
 H01K), C01E(H01L,H01M), C01I(H01P,H01Q), C01O(H01T,H01U), C01Z(H0AA,H),
 C020(H02A,H02B), C025(H02C,H02D), C027(H02E,H02F), C02P(H02R,H02S), C02X(H02Y,
 HA), C033(H03A,H03B), C03R(H03H,H03I), C47(H47A,H47B)
4.b Aromatic/amide H refined with riding coordinates:
 C013(H013), C017(H017), C01B(H01I), C01F(H01N), C01G(H01O), C01K(H01R),
 C01L(H01S), C01P(H01V), C01Q(H01W), C01S(H01X), C01T(H01Y), C01X(H01Z),
 C01Y(H01), C021(H021), C022(H022), C023(H023), C024(H024), C026(H026),
 C028(H028), C029(H029), C02A(H02G), C02B(H02H), C02C(H02I), C02E(H02J),
 C02F(H02K), C02G(H02L), C02H(H02M), C02J(H02N), C02K(H02O), C02M(H02P),
 C02O(H02Q), C02Q(H02T), C02R(H02U), C02S(H02V), C02T(H02W), C02W(H02X),
 C02Y(H02Z), C02Z(H02), C031(H031), C032(H032), C034(H034), C035(H035),
 C036(H036), C037(H037), C038(H038), C039(H039), C03A(H03C), C03B(H03D),
 C03C(H03E), C03D(H03F), C03E(H03G), C03J(H03J), C03K(H03K), C03L(H03L),
 C03M(H03M), C03N(H03N), C03O(H03O), C03P(H03P), C03Q(H03Q), C03S(H03S),
 C03T(H03T), C03W(H03W), C03X(H03X), C03Z(H03Z), C040(H040), C043(H043),
 C044(H044), C045(H045), C19(H19), C35(H35), C39(H39), C43(H43), C44(H44),
 C51(H51), C62(H62), C65(H65), C72(H72), C86(H86), C131(H131), C40(H40)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_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
Au01 Au 0.40516(3) 0.29161(3) 0.66835(2) 0.02987(15) Uani 1 1 d . . . . .
Au02 Au 0.40195(4) 0.26078(3) 0.54330(3) 0.03225(16) Uani 1 1 d . . . . .
Au03 Au 0.55099(4) 0.28760(3) 0.64932(3) 0.03300(16) Uani 1 1 d . . . . .
Au04 Au 0.50255(4) 0.40361(3) 0.65503(3) 0.03380(16) Uani 1 1 d . . . . .
Au05 Au 0.25701(4) 0.20233(3) 0.56763(3) 0.03361(16) Uani 1 1 d . . . . .
Au06 Au 0.39775(4) 0.31041(4) 0.78971(3) 0.03844(17) Uani 1 1 d . . . . .
Au07 Au 0.48912(4) 0.22978(3) 0.73140(3) 0.03572(16) Uani 1 1 d . . . . .
Au08 Au 0.26142(4) 0.30257(3) 0.68862(3) 0.03666(17) Uani 1 1 d . . . . .
Au09 Au 0.41266(4) 0.42325(3) 0.74112(3) 0.03902(17) Uani 1 1 d . . . . .
Ag0A Ag 0.55081(6) 0.38149(5) 0.77549(5) 0.0328(2) Uani 1 1 d . . . . .
Ag0B Ag 0.39924(6) 0.15727(5) 0.59295(5) 0.0329(2) Uani 1 1 d . . . . .
Ag0C Ag 0.32334(6) 0.35404(6) 0.59996(5) 0.0347(2) Uani 1 1 d D . . . .
Ag0D Ag 0.30832(7) 0.17426(6) 0.67838(5) 0.0380(2) Uani 1 1 d . . . . .
P0E P 0.6683(2) 0.2726(2) 0.63277(19) 0.0358(8) Uani 1 1 d . . . . .
P0F P 0.5736(2) 0.5021(2) 0.64524(19) 0.0366(8) Uani 1 1 d . . . . .
P0G P 0.4084(2) 0.2468(2) 0.44281(18) 0.0356(8) Uani 1 1 d . . . . .
P0H P 0.1313(2) 0.1296(2) 0.48454(18) 0.0372(8) Uani 1 1 d . . . . .
P0I P 0.1338(2) 0.2990(2) 0.6971(2) 0.0430(9) Uani 1 1 d . . . . .
P0J P 0.4252(3) 0.5321(2) 0.8130(2) 0.0417(9) Uani 1 1 d . . . . .
P0K P 0.3872(3) 0.3243(2) 0.88976(18) 0.0414(9) Uani 1 1 d . . . . .
P0L P 0.5553(3) 0.1704(2) 0.7765(2) 0.0461(9) Uani 1 1 d . . . . .
Cl0M Cl 0.1668(5) -0.1699(6) 0.5135(7) 0.164(5) Uani 1 1 d D . . . .
Cl00 Cl 0.6712(8) 0.4761(9) 0.8788(13) 0.331(17) Uani 1 1 d . . . . .
Cl1 Cl 0.2604(8) -0.0975(10) 0.6510(8) 0.191(6) Uani 1 1 d D . . . .
Cl2 Cl 0.1965(14) 0.0660(14) 0.6693(16) 0.364(18) Uani 1 1 d . . . . .
Cl3 Cl 0.2652(9) 0.4172(6) 0.5371(8) 0.230(7) Uani 1 1 d D U . A 1
Cl4 Cl 0.3927(7) 0.0369(9) 0.5309(8) 0.270(13) Uani 1 1 d . . . . .
C00Y C 0.6827(9) 0.5370(9) 0.6891(8) 0.044(4) Uani 1 1 d . . . . .
C011 C 0.6048(12) 0.1365(8) 0.6265(8) 0.044(4) Uani 1 1 d . . . . .
H01A H 0.590462 0.086245 0.600363 0.052 Uiso 1 1 calc R . . . .
H01B H 0.553143 0.144017 0.623679 0.052 Uiso 1 1 calc R . . . .
C012 C 0.7063(9) 0.3085(8) 0.5805(8) 0.037(3) Uani 1 1 d . . . . .
C013 C 0.6969(11) 0.2647(11) 0.5164(8) 0.048(4) Uani 1 1 d . . . . .
H013 H 0.671985 0.215480 0.499264 0.058 Uiso 1 1 calc R . . . .
C014 C 0.6498(10) 0.1777(9) 0.5958(8) 0.042(4) Uani 1 1 d . . . . .
H01C H 0.617285 0.157514 0.549585 0.051 Uiso 1 1 calc R . . . .
H01D H 0.702716 0.172287 0.600021 0.051 Uiso 1 1 calc R . . . .
C016 C 0.5945(10) 0.4446(8) 0.5211(8) 0.040(3) Uani 1 1 d . . . . .
H01E H 0.590109 0.451782 0.481915 0.049 Uiso 1 1 calc R . . . .
H01F H 0.653050 0.461057 0.546447 0.049 Uiso 1 1 calc R . . . .
C017 C 0.7138(12) 0.5284(11) 0.7426(8) 0.055(4) Uani 1 1 d . . . . .
H017 H 0.678078 0.500520 0.755070 0.065 Uiso 1 1 calc R . . . .
C019 C 0.5546(9) 0.3645(8) 0.5010(6) 0.034(3) Uani 1 1 d . . . . .
H01G H 0.588721 0.340696 0.483465 0.041 Uiso 1 1 calc R . . . .
H01H H 0.551782 0.356866 0.539046 0.041 Uiso 1 1 calc R . . . .
C01B C 0.2403(13) 0.2098(10) 0.8300(9) 0.058(5) Uani 1 1 d . . . . .
H01I H 0.258953 0.196780 0.795456 0.070 Uiso 1 1 calc R . . . .
C01C C 0.6507(11) 0.1539(9) 0.6975(8) 0.043(4) Uani 1 1 d . . . . .
H01J H 0.669249 0.204671 0.723917 0.052 Uiso 1 1 calc R . . . .
H01K H 0.699395 0.141558 0.700438 0.052 Uiso 1 1 calc R . . . .
C01D C 0.0910(11) 0.1777(8) 0.4418(8) 0.045(4) Uani 1 1 d . . . . .
C01E C 0.0756(11) 0.1504(10) 0.6275(8) 0.052(5) Uani 1 1 d . . . . .
H01L H 0.054724 0.106411 0.631362 0.063 Uiso 1 1 calc R . . . .
H01M H 0.133580 0.160416 0.632744 0.063 Uiso 1 1 calc R . . . .
C01F C 0.1210(11) 0.2648(9) 0.4003(9) 0.047(4) Uani 1 1 d . . . . .
H01N H 0.158637 0.295934 0.391805 0.057 Uiso 1 1 calc R . . . .
C01G C 0.0805(11) -0.0476(9) 0.3187(9) 0.054(4) Uani 1 1 d . . . . .
H01O H 0.038760 -0.074788 0.277625 0.064 Uiso 1 1 calc R . . . .
C01H C 0.7608(9) 0.3160(9) 0.7070(7) 0.041(3) Uani 1 1 d . . . . .
C01I C 0.0275(10) 0.1394(10) 0.5589(8) 0.049(4) Uani 1 1 d . . . . .
H01P H 0.041627 0.184678 0.556456 0.059 Uiso 1 1 calc R . . . .
H01Q H -0.031685 0.120880 0.550014 0.059 Uiso 1 1 calc R . . . .
C01K C 0.5374(12) 0.1455(10) 0.3470(10) 0.054(4) Uani 1 1 d . . . . .
H01R H 0.565693 0.150400 0.319282 0.065 Uiso 1 1 calc R . . . .
C01L C 0.1490(10) 0.2276(8) 0.4347(8) 0.044(4) Uani 1 1 d . . . . .
H01S H 0.205293 0.236618 0.452020 0.053 Uiso 1 1 calc R . . . .
C01M C 0.1349(10) 0.3593(11) 0.7739(8) 0.051(4) Uani 1 1 d . . . . .
C01O C 0.4681(9) 0.3331(7) 0.4500(6) 0.029(3) Uani 1 1 d . . . . .
H01T H 0.471997 0.327916 0.408040 0.035 Uiso 1 1 calc R . . . .
H01U H 0.439510 0.365243 0.461788 0.035 Uiso 1 1 calc R . . . .
C01P C 0.1893(15) 0.1113(13) 0.2938(10) 0.076(7) Uani 1 1 d . . . . .
H01V H 0.154773 0.063851 0.276888 0.092 Uiso 1 1 calc R . . . .
C01Q C 0.3178(14) 0.6078(11) 0.8296(11) 0.064(6) Uani 1 1 d . . . . .
H01W H 0.352416 0.632486 0.873372 0.077 Uiso 1 1 calc R . . . .
C01R C 0.1359(10) 0.0507(9) 0.4244(8) 0.043(4) Uani 1 1 d . . . . .
C01S C 0.7467(10) 0.3792(10) 0.6049(10) 0.051(4) Uani 1 1 d . . . . .
H01X H 0.755055 0.408467 0.647589 0.061 Uiso 1 1 calc R . . . .
C01T C 0.4528(11) 0.5582(9) 0.6499(9) 0.047(4) Uani 1 1 d . . . . .
H01Y H 0.416108 0.511754 0.622114 0.057 Uiso 1 1 calc R . . . .
C01U C 0.3388(10) 0.5551(9) 0.7861(9) 0.046(4) Uani 1 1 d . . . . .
C01V C 0.4851(11) 0.1072(10) 0.7947(9) 0.047(4) Uani 1 1 d . . . . .
C01W C 0.5184(9) 0.6020(9) 0.8372(7) 0.041(3) Uani 1 1 d . . . . .
C01X C 0.1972(13) 0.0285(10) 0.4417(9) 0.060(5) Uani 1 1 d . . . . .
H01Z H 0.236659 0.053072 0.483815 0.072 Uiso 1 1 calc R . . . .
C01Y C 0.7626(11) 0.3700(10) 0.7620(8) 0.052(4) Uani 1 1 d . . . . .
H01 H 0.715753 0.381429 0.760858 0.063 Uiso 1 1 calc R . . . .
C01Z C 0.0701(11) 0.2098(10) 0.6824(9) 0.053(4) Uani 1 1 d . . . . .
H0AA H 0.087126 0.204107 0.722233 0.063 Uiso 1 1 calc R . . . .
H H 0.012650 0.205578 0.672103 0.063 Uiso 1 1 calc R . . . .
C020 C 0.4137(10) 0.4148(9) 0.9482(7) 0.041(3) Uani 1 1 d . . . . .
H02A H 0.418821 0.414486 0.990291 0.049 Uiso 1 1 calc R . . . .
H02B H 0.468232 0.442873 0.952079 0.049 Uiso 1 1 calc R . . . .
C021 C 0.1692(11) 0.1540(12) 0.2656(9) 0.062(5) Uani 1 1 d . . . . .
H021 H 0.121822 0.133810 0.228187 0.075 Uiso 1 1 calc R . . . .
C022 C 0.1679(14) 0.1680(13) 0.8265(12) 0.071(6) Uani 1 1 d . . . . .
H022 H 0.137203 0.125530 0.789009 0.085 Uiso 1 1 calc R . . . .
C023 C 0.5019(11) 0.1937(10) 0.3716(9) 0.050(4) Uani 1 1 d . . . . .
H023 H 0.506771 0.230816 0.359508 0.060 Uiso 1 1 calc R . . . .
C024 C 0.7638(11) 0.3681(11) 0.5043(10) 0.056(5) Uani 1 1 d . . . . .
H024 H 0.780517 0.387418 0.477401 0.067 Uiso 1 1 calc R . . . .
C025 C 0.0488(9) 0.0871(8) 0.5076(8) 0.040(3) Uani 1 1 d . . . . .
H02C H -0.000878 0.058087 0.468746 0.049 Uiso 1 1 calc R . . . .
H02D H 0.065302 0.055764 0.524669 0.049 Uiso 1 1 calc R . . . .
C026 C 0.6695(14) 0.6437(13) 0.8693(10) 0.074(7) Uani 1 1 d . . . . .
H026 H 0.717983 0.635020 0.870271 0.088 Uiso 1 1 calc R . . . .
C027 C 0.5560(11) 0.4909(8) 0.5614(8) 0.041(3) Uani 1 1 d . . . . .
H02E H 0.496529 0.470796 0.537743 0.050 Uiso 1 1 calc R . . . .
H02F H 0.576813 0.537785 0.562834 0.050 Uiso 1 1 calc R . . . .
C028 C 0.4585(11) 0.1332(9) 0.4338(9) 0.047(4) Uani 1 1 d . . . . .
H028 H 0.432188 0.129110 0.462867 0.056 Uiso 1 1 calc R . . . .
C029 C 0.2874(13) 0.5248(10) 0.7204(10) 0.055(4) Uani 1 1 d . . . . .
H029 H 0.298490 0.491245 0.689725 0.066 Uiso 1 1 calc R . . . .
C02A C 0.5296(12) 0.0874(10) 0.3655(9) 0.054(4) Uani 1 1 d . . . . .
H02G H 0.547539 0.051491 0.346441 0.065 Uiso 1 1 calc R . . . .
C02B C 0.5963(11) 0.5902(9) 0.8433(9) 0.049(4) Uani 1 1 d . . . . .
H02H H 0.594603 0.543869 0.828488 0.059 Uiso 1 1 calc R . . . .
C02C C 0.7397(11) 0.5793(10) 0.6684(10) 0.056(5) Uani 1 1 d . . . . .
H02I H 0.719324 0.588143 0.632815 0.067 Uiso 1 1 calc R . . . .
C02D C 0.4600(10) 0.1892(8) 0.4128(7) 0.039(3) Uani 1 1 d . . . . .
C02E C 0.1420(16) -0.0699(11) 0.3356(11) 0.072(6) Uani 1 1 d . . . . .
H02J H 0.143309 -0.110947 0.305910 0.086 Uiso 1 1 calc R . . . .
C02F C 0.7246(11) 0.2954(12) 0.4806(10) 0.055(5) Uani 1 1 d . . . . .
H02K H 0.717117 0.266524 0.437967 0.065 Uiso 1 1 calc R . . . .
C02G C 0.7772(12) 0.4097(12) 0.5648(10) 0.061(5) Uani 1 1 d . . . . .
H02L H 0.806063 0.458425 0.581809 0.073 Uiso 1 1 calc R . . . .
C02H C 0.4232(14) 0.6122(11) 0.6677(10) 0.057(5) Uani 1 1 d . . . . .
H02M H 0.366017 0.600257 0.652434 0.069 Uiso 1 1 calc R . . . .
C02I C 0.2878(14) 0.2735(11) 0.8864(9) 0.059(5) Uani 1 1 d . . . . .
C02J C 0.2908(9) 0.2526(9) 0.3450(8) 0.044(4) Uani 1 1 d . . . . .
H02N H 0.326487 0.299589 0.361205 0.053 Uiso 1 1 calc R . . . .
C02K C 0.0767(12) 0.0143(9) 0.3601(8) 0.056(5) Uani 1 1 d . . . . .
H02O H 0.036651 0.031362 0.346084 0.067 Uiso 1 1 calc R . . . .
C02L C 0.0730(10) 0.3190(10) 0.6380(9) 0.050(4) Uani 1 1 d . . . . .
C02M C 0.8005(13) 0.5609(14) 0.7811(11) 0.079(7) Uani 1 1 d . . . . .
H02P H 0.820607 0.555694 0.818952 0.095 Uiso 1 1 calc R . . . .
C02O C 0.0073(11) 0.1644(10) 0.4182(9) 0.048(4) Uani 1 1 d . . . . .
H02Q H -0.030858 0.130370 0.423560 0.057 Uiso 1 1 calc R . . . .
C02P C 0.4268(10) 0.5279(11) 0.8898(9) 0.050(4) Uani 1 1 d . . . . .
H02R H 0.473962 0.516982 0.907295 0.060 Uiso 1 1 calc R . . . .
H02S H 0.432424 0.573597 0.921335 0.060 Uiso 1 1 calc R . . . .
C02Q C 0.0364(13) 0.2548(11) 0.3790(12) 0.062(5) Uani 1 1 d . . . . .
H02T H 0.019065 0.283026 0.360747 0.075 Uiso 1 1 calc R . . . .
C02R C 0.1288(14) 0.3394(18) 0.8239(11) 0.088(9) Uani 1 1 d . . . . .
H02U H 0.125119 0.294123 0.819525 0.106 Uiso 1 1 calc R . . . .
C02S C 0.1051(10) 0.3390(10) 0.5967(9) 0.048(4) Uani 1 1 d . . . . .
H02V H 0.158231 0.340784 0.598682 0.058 Uiso 1 1 calc R . . . .
C02T C -0.0197(13) 0.2042(11) 0.3852(10) 0.065(6) Uani 1 1 d . . . . .
H02W H -0.076041 0.195119 0.367925 0.078 Uiso 1 1 calc R . . . .
C02V C 0.6491(16) 0.2318(16) 0.8493(11) 0.079(4) Uani 1 1 d . U . . .
C02W C -0.0071(15) 0.3148(14) 0.6328(15) 0.079(7) Uani 1 1 d . . . . .
H02X H -0.030901 0.297806 0.658358 0.095 Uiso 1 1 calc R . . . .
C02X C 0.5956(15) 0.1138(10) 0.7246(10) 0.058(5) Uani 1 1 d . . . . .
H02Y H 0.627670 0.095723 0.749721 0.069 Uiso 1 1 calc R . . . .
HA H 0.549468 0.073450 0.688441 0.069 Uiso 1 1 calc R . . . .
C02Y C 0.2246(13) 0.5418(12) 0.7003(12) 0.068(6) Uani 1 1 d . . . . .
H02Z H 0.192315 0.521312 0.656113 0.082 Uiso 1 1 calc R . . . .
C02Z C 0.8306(11) 0.4057(15) 0.8162(10) 0.085(9) Uani 1 1 d . . . . .
H02 H 0.833909 0.445300 0.850797 0.102 Uiso 1 1 calc R . . . .
C030 C 0.5357(11) 0.5732(9) 0.6733(8) 0.044(4) Uani 1 1 d . . . . .
C031 C 0.8531(12) 0.5995(14) 0.7618(11) 0.080(8) Uani 1 1 d . . . . .
H031 H 0.909331 0.622450 0.787433 0.097 Uiso 1 1 calc R . . . .
C032 C 0.2160(11) 0.2250(11) 0.2903(9) 0.058(5) Uani 1 1 d . . . . .
H032 H 0.199657 0.253637 0.272186 0.070 Uiso 1 1 calc R . . . .
C033 C 0.3461(12) 0.4704(11) 0.8783(9) 0.058(5) Uani 1 1 d . . . . .
H03A H 0.300572 0.486642 0.871095 0.070 Uiso 1 1 calc R . . . .
H03B H 0.333491 0.427519 0.839695 0.070 Uiso 1 1 calc R . . . .
C034 C 0.6721(17) 0.7154(13) 0.8958(12) 0.080(7) Uani 1 1 d . . . . .
H034 H 0.723316 0.752939 0.918473 0.096 Uiso 1 1 calc R . . . .
C035 C 0.5433(11) 0.3267(13) 0.9481(9) 0.060(5) Uani 1 1 d . . . . .
H035 H 0.561026 0.360394 0.933126 0.072 Uiso 1 1 calc R . . . .
C036 C 0.4204(15) 0.1216(12) 0.8086(13) 0.076(7) Uani 1 1 d . . . . .
H036 H 0.414801 0.163923 0.810892 0.091 Uiso 1 1 calc R . . . .
C037 C 0.8222(11) 0.6049(12) 0.7020(11) 0.060(5) Uani 1 1 d . . . . .
H037 H 0.859201 0.626229 0.686142 0.072 Uiso 1 1 calc R . . . .
C038 C 0.4710(13) 0.6796(10) 0.7049(9) 0.053(5) Uani 1 1 d . . . . .
H038 H 0.448843 0.714657 0.714783 0.064 Uiso 1 1 calc R . . . .
C039 C 0.1383(15) 0.4286(13) 0.7831(12) 0.078(7) Uani 1 1 d . . . . .
H039 H 0.141328 0.443071 0.750376 0.093 Uiso 1 1 calc R . . . .
C03A C 0.5293(14) 0.6771(9) 0.8612(10) 0.057(5) Uani 1 1 d . . . . .
H03C H 0.481925 0.688099 0.856450 0.069 Uiso 1 1 calc R . . . .
C03B C 0.1355(15) 0.1859(13) 0.8782(12) 0.076(7) Uani 1 1 d . . . . .
H03D H 0.083763 0.157894 0.874490 0.091 Uiso 1 1 calc R . . . .
C03C C 0.2585(12) 0.2920(11) 0.9364(9) 0.056(5) Uani 1 1 d . . . . .
H03E H 0.287853 0.335427 0.972936 0.067 Uiso 1 1 calc R . . . .
C03D C 0.1304(14) 0.450(2) 0.8905(11) 0.097(11) Uani 1 1 d . . . . .
H03F H 0.127805 0.478911 0.929254 0.116 Uiso 1 1 calc R . . . .
C03E C 0.1856(12) 0.2464(12) 0.9326(10) 0.066(6) Uani 1 1 d . . . . .
H03G H 0.170231 0.257600 0.969022 0.079 Uiso 1 1 calc R . . . .
C03G C 0.3109(11) 0.2113(9) 0.3739(7) 0.044(4) Uani 1 1 d . . . . .
C03J C 0.9010(13) 0.3805(18) 0.8200(10) 0.095(10) Uani 1 1 d . . . . .
H03J H 0.947833 0.402303 0.858077 0.114 Uiso 1 1 calc R . . . .
C03K C 0.2025(17) -0.0327(13) 0.3960(12) 0.088(9) Uani 1 1 d . . . . .
H03K H 0.246559 -0.046763 0.407289 0.106 Uiso 1 1 calc R . . . .
C03L C 0.6822(16) 0.2015(16) 0.8916(11) 0.081(4) Uani 1 1 d . U . . .
H03L H 0.656233 0.155834 0.887000 0.097 Uiso 1 1 calc R . . . .
C03M C 0.5910(12) 0.6429(9) 0.7148(8) 0.045(4) Uani 1 1 d . . . . .
H03M H 0.647820 0.654059 0.732525 0.054 Uiso 1 1 calc R . . . .
C03N C 0.1285(15) 0.3880(15) 0.8793(11) 0.080(7) Uani 1 1 d . . . . .
H03N H 0.126720 0.374094 0.912514 0.095 Uiso 1 1 calc R . . . .
C03O C 0.5562(15) 0.6960(11) 0.7287(11) 0.063(5) Uani 1 1 d . . . . .
H03O H 0.591517 0.743228 0.754658 0.075 Uiso 1 1 calc R . . . .
C03P C 0.4306(18) 0.2456(15) 0.9534(11) 0.080(7) Uani 1 1 d . . . . .
H03P H 0.374066 0.223826 0.943638 0.096 Uiso 1 1 calc R . . . .
C03Q C 0.1371(15) 0.4731(15) 0.8392(17) 0.103(12) Uani 1 1 d . . . . .
H03Q H 0.140409 0.518834 0.845641 0.123 Uiso 1 1 calc R . . . .
C03R C 0.3556(13) 0.4546(11) 0.9358(11) 0.063(5) Uani 1 1 d . . . . .
H03H H 0.300836 0.426774 0.931813 0.075 Uiso 1 1 calc R . . . .
H03I H 0.375498 0.499366 0.974377 0.075 Uiso 1 1 calc R . . . .
C03S C 0.2626(12) 0.1406(10) 0.3485(8) 0.055(4) Uani 1 1 d . . . . .
H03S H 0.278342 0.112341 0.367392 0.065 Uiso 1 1 calc R . . . .
C03T C 0.6835(16) 0.2977(16) 0.8619(11) 0.082(4) Uani 1 1 d . U . . .
H03T H 0.660761 0.314843 0.833509 0.098 Uiso 1 1 calc R . . . .
C03W C 0.5729(17) 0.2563(14) 1.0026(10) 0.073(6) Uani 1 1 d . . . . .
H03W H 0.610578 0.243343 1.026249 0.087 Uiso 1 1 calc R . . . .
C03X C 0.8270(11) 0.2948(11) 0.7090(10) 0.057(5) Uani 1 1 d . . . . .
H03X H 0.827591 0.259998 0.672370 0.068 Uiso 1 1 calc R . . . .
C03Z C 0.6007(14) 0.3081(13) 0.9815(9) 0.066(6) Uani 1 1 d . . . . .
H03Z H 0.656909 0.329400 0.989872 0.079 Uiso 1 1 calc R . . . .
C040 C 0.4893(17) 0.2247(16) 0.9879(12) 0.083(7) Uani 1 1 d . . . . .
H040 H 0.470471 0.189052 1.000514 0.099 Uiso 1 1 calc R . . . .
C043 C 0.4949(13) 0.0867(10) 0.4117(11) 0.059(5) Uani 1 1 d . . . . .
H043 H 0.496422 0.053476 0.428389 0.071 Uiso 1 1 calc R . . . .
C044 C 0.6012(15) 0.7296(11) 0.8887(11) 0.067(6) Uani 1 1 d . . . . .
H044 H 0.604263 0.776364 0.903311 0.080 Uiso 1 1 calc R . . . .
C045 C 0.0588(13) 0.3573(14) 0.5507(11) 0.075(7) Uani 1 1 d . . . . .
H045 H 0.080743 0.371240 0.522910 0.090 Uiso 1 1 calc R . . . .
C04A C 0.4579(12) 0.2960(10) 0.9360(8) 0.051(4) Uani 1 1 d . . . . .
C19 C 0.363(3) 0.0755(16) 0.8191(19) 0.122(14) Uani 1 1 d . . . . .
H19 H 0.313809 0.081263 0.819610 0.146 Uiso 1 1 calc R . . . .
Cl14 Cl -0.0553(10) 0.0275(11) 0.2128(10) 0.258(11) Uani 1 1 d . . . . .
C35 C -0.0163(18) 0.3536(19) 0.5492(16) 0.096(10) Uani 1 1 d . . . . .
H35 H -0.048077 0.363904 0.518721 0.116 Uiso 1 1 calc R . . . .
C39 C 0.8957(13) 0.3293(17) 0.7708(14) 0.093(9) Uani 1 1 d . . . . .
H39 H 0.938646 0.312438 0.774298 0.112 Uiso 1 1 calc R . . . .
C43 C 0.7629(16) 0.2536(16) 0.9429(11) 0.085(4) Uani 1 1 d . U . . .
H43 H 0.795912 0.237671 0.967078 0.102 Uiso 1 1 calc R . . . .
C44 C 0.379(2) 0.0214(19) 0.8289(17) 0.109(11) Uani 1 1 d . . . . .
H44 H 0.346331 -0.006249 0.843188 0.131 Uiso 1 1 calc R . . . .
C51 C 0.495(2) 0.0522(16) 0.8001(16) 0.095(9) Uani 1 1 d . . . . .
H51 H 0.540057 0.042391 0.791519 0.114 Uiso 1 1 calc R . . . .
C62 C -0.0510(16) 0.3342(17) 0.5928(15) 0.097(9) Uani 1 1 d . . . . .
H62 H -0.102617 0.335258 0.592908 0.117 Uiso 1 1 calc R . . . .
C65 C 0.2059(14) 0.5925(12) 0.7475(13) 0.071(6) Uani 1 1 d . . . . .
H65 H 0.160825 0.604834 0.734399 0.085 Uiso 1 1 calc R . . . .
C72 C 0.2547(14) 0.6221(13) 0.8113(11) 0.069(6) Uani 1 1 d . . . . .
H72 H 0.241651 0.653575 0.842193 0.083 Uiso 1 1 calc R . . . .
C86 C 0.7559(16) 0.3448(17) 0.9189(11) 0.085(4) Uani 1 1 d . U . . .
H86 H 0.777153 0.392660 0.928071 0.102 Uiso 1 1 calc R . . . .
C131 C 0.7910(17) 0.3238(17) 0.9563(12) 0.087(4) Uani 1 1 d . U . . .
H131 H 0.836851 0.356057 0.993792 0.105 Uiso 1 1 calc R . . . .
C40 C 0.4489(18) 0.0090(17) 0.8164(17) 0.095(9) Uani 1 1 d . . . . .
H40 H 0.461258 -0.029081 0.819706 0.114 Uiso 1 1 calc R . . . .
C47 C 0.2427(17) -0.1006(11) 0.5771(8) 0.18(2) Uani 1 1 d D . . . .
H47A H 0.293717 -0.096934 0.568547 0.214 Uiso 1 1 calc R . . . .
H47B H 0.232016 -0.058473 0.578550 0.214 Uiso 1 1 calc R . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
Ag Ag 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -4.4197 7.2980 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 '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
_geom_angle_publ_flag
CL3a Ag0C Au01 173.4(4) . . ?
CL3a Ag0C Au02 118.8(4) . . ?
Au02 Au01 Au03 64.40(2) . . ?
Au02 Au01 Au04 65.68(2) . . ?
Au02 Au01 Au06 174.83(3) . . ?
Au02 Au01 Au07 115.11(3) . . ?
Au02 Au01 Au08 115.44(3) . . ?
Au02 Au01 Ag0A 120.69(3) . . ?
Au02 Au01 Ag0B 61.93(3) . . ?
Au02 Au01 Ag0C 62.44(3) . . ?
Au02 Au01 Ag0D 112.53(3) . . ?
Au03 Au01 Au08 177.20(3) . . ?
Au03 Au01 Ag0A 64.24(3) . . ?
Au03 Au01 Ag0B 64.57(3) . . ?
Au03 Au01 Ag0C 114.02(3) . . ?
Au03 Au01 Ag0D 116.40(3) . . ?
Au04 Au01 Au03 61.67(2) . . ?
Au04 Au01 Au06 119.48(3) . . ?
Au04 Au01 Au08 115.59(3) . . ?
Au04 Au01 Ag0A 65.18(3) . . ?
Au04 Au01 Ag0B 116.28(3) . . ?
Au04 Au01 Ag0C 62.64(3) . . ?
Au04 Au01 Ag0D 177.69(3) . . ?
Au05 Au01 Au02 62.61(2) . . ?
Au05 Au01 Au03 118.58(2) . . ?
Au05 Au01 Au04 117.39(3) . . ?
Au05 Au01 Au06 113.00(3) . . ?
Au05 Au01 Au07 116.53(3) . . ?
Au05 Au01 Au08 62.85(2) . . ?
Au05 Au01 Ag0A 176.70(3) . . ?
Au05 Au01 Ag0B 64.60(3) . . ?
Au05 Au01 Ag0C 63.58(3) . . ?
Au05 Au01 Ag0D 62.08(3) . . ?
Au06 Au01 Au03 117.71(3) . . ?
Au06 Au01 Au08 62.71(2) . . ?
Au06 Au01 Ag0A 63.71(3) . . ?
Au06 Au01 Ag0B 114.16(3) . . ?
Au06 Au01 Ag0C 118.81(3) . . ?
Au06 Au01 Ag0D 62.32(3) . . ?
Au07 Au01 Au03 63.49(2) . . ?
Au07 Au01 Au04 115.78(3) . . ?
Au07 Au01 Au06 63.72(2) . . ?
Au07 Au01 Au08 118.40(3) . . ?
Au07 Au01 Ag0A 62.70(3) . . ?
Au07 Au01 Ag0B 62.41(3) . . ?
Au07 Au01 Ag0C 177.37(3) . . ?
CL3a Ag0C Au04 116.0(3) . . ?
CL3a Ag0C Au05 127.1(3) . . ?
CL3a Ag0C Au08 128.8(4) . . ?
CL3a Ag0C Au09 123.0(3) . . ?
Au07 Au01 Ag0D 63.37(3) . . ?
Au08 Au01 Ag0A 114.41(3) . . ?
Au08 Au01 Ag0B 118.01(3) . . ?
Au08 Au01 Ag0C 64.13(3) . . ?
Au08 Au01 Ag0D 66.35(3) . . ?
Au09 Au01 Au02 117.45(3) . . ?
Au09 Au01 Au03 114.69(3) . . ?
Au09 Au01 Au04 62.87(2) . . ?
Au09 Au01 Au05 115.75(3) . . ?
Au09 Au01 Au06 66.50(2) . . ?
Au09 Au01 Au07 117.76(3) . . ?
Au09 Au01 Au08 62.73(2) . . ?
Au09 Au01 Ag0A 63.12(3) . . ?
Au09 Au01 Ag0B 179.14(3) . . ?
Au09 Au01 Ag0C 63.74(3) . . ?
Au09 Au01 Ag0D 119.43(3) . . ?
Ag0A Au01 Ag0B 116.57(4) . . ?
Ag0A Au01 Ag0C 117.36(4) . . ?
Ag0A Au01 Ag0D 115.44(4) . . ?
Ag0B Au01 Ag0C 116.06(3) . . ?
Ag0B Au01 Ag0D 61.42(3) . . ?
Ag0D Au01 Ag0C 118.12(4) . . ?
Au01 Au02 Au03 58.097(19) . . ?
Au01 Au02 Au04 57.234(19) . . ?
Au01 Au02 Au05 58.59(2) . . ?
Au01 Au02 Ag0B 59.70(3) . . ?
Au01 Au02 Ag0C 59.88(3) . . ?
Au03 Au02 Au04 57.07(2) . . ?
Au05 Au02 Au03 109.72(2) . . ?
Au05 Au02 Au04 107.10(2) . . ?
Au05 Au02 Ag0C 61.37(3) . . ?
Ag0B Au02 Au03 61.64(3) . . ?
Ag0B Au02 Au04 107.56(3) . . ?
Ag0B Au02 Au05 62.44(3) . . ?
Ag0B Au02 Ag0C 111.96(3) . . ?
Ag0C Au02 Au03 106.99(3) . . ?
Ag0C Au02 Au04 59.08(3) . . ?
P0G Au02 Au01 174.17(10) . . ?
P0G Au02 Au03 119.69(10) . . ?
P0G Au02 Au04 116.94(10) . . ?
P0G Au02 Au05 125.99(10) . . ?
P0G Au02 Ag0B 124.87(10) . . ?
P0G Au02 Ag0C 117.99(11) . . ?
Au01 Au03 Au02 57.505(19) . . ?
Au01 Au03 Au04 58.93(2) . . ?
Au01 Au03 Au07 57.95(2) . . ?
Au01 Au03 Ag0A 58.12(2) . . ?
Au01 Au03 Ag0B 58.06(3) . . ?
Au02 Au03 Ag0A 109.39(3) . . ?
Au02 Au03 Ag0B 57.68(3) . . ?
Au04 Au03 Au02 62.26(2) . . ?
Au04 Au03 Au07 108.81(3) . . ?
Au04 Au03 Ag0A 62.07(3) . . ?
Au04 Au03 Ag0B 108.55(3) . . ?
Au07 Au03 Au02 105.18(2) . . ?
Au07 Au03 Ag0A 58.89(3) . . ?
Au07 Au03 Ag0B 58.51(3) . . ?
Ag0A Au03 Ag0B 106.39(3) . . ?
P0E Au03 Au01 174.12(11) . . ?
P0E Au03 Au02 123.23(10) . . ?
P0E Au03 Au04 126.92(11) . . ?
P0E Au03 Au07 117.52(10) . . ?
P0E Au03 Ag0A 123.88(10) . . ?
P0E Au03 Ag0B 116.78(10) . . ?
Au01 Au04 Au02 57.088(19) . . ?
Au01 Au04 Au03 59.40(2) . . ?
Au01 Au04 Au09 57.88(2) . . ?
Au01 Au04 Ag0A 57.86(2) . . ?
Au01 Au04 Ag0C 59.70(3) . . ?
Au03 Au04 Au02 60.67(2) . . ?
Au03 Au04 Au09 108.63(3) . . ?
Au03 Au04 Ag0A 60.95(3) . . ?
Au03 Au04 Ag0C 109.72(3) . . ?
Au09 Au04 Au02 106.25(2) . . ?
Au09 Au04 Ag0A 59.05(3) . . ?
Au09 Au04 Ag0C 61.07(3) . . ?
Ag0A Au04 Au02 107.35(3) . . ?
Ag0C Au04 Au02 58.74(3) . . ?
Ag0C Au04 Ag0A 108.86(3) . . ?
P0F Au04 Au01 174.05(10) . . ?
P0F Au04 Au02 124.49(10) . . ?
P0F Au04 Au03 126.55(10) . . ?
P0F Au04 Au09 117.24(10) . . ?
P0F Au04 Ag0A 123.70(10) . . ?
P0F Au04 Ag0C 115.49(10) . . ?
Au01 Au05 Au02 58.799(19) . . ?
Au01 Au05 Au08 59.161(19) . . ?
Au01 Au05 Ag0B 58.43(2) . . ?
Au01 Au05 Ag0C 59.38(3) . . ?
Au01 Au05 Ag0D 59.86(3) . . ?
Au02 Au05 Au08 109.21(2) . . ?
Au02 Au05 Ag0B 58.71(3) . . ?
Au02 Au05 Ag0C 59.82(3) . . ?
Au02 Au05 Ag0D 107.72(3) . . ?
Au08 Au05 Ag0B 109.70(3) . . ?
Au08 Au05 Ag0C 61.49(3) . . ?
Ag0C Au05 Ag0B 107.73(3) . . ?
Ag0D Au05 Au08 64.25(3) . . ?
Ag0D Au05 Ag0B 58.73(3) . . ?
Ag0D Au05 Ag0C 112.55(4) . . ?
P0H Au05 Au01 178.42(11) . . ?
P0H Au05 Au02 122.07(10) . . ?
P0H Au05 Au08 119.36(10) . . ?
P0H Au05 Ag0B 123.09(11) . . ?
P0H Au05 Ag0C 119.66(11) . . ?
P0H Au05 Ag0D 120.30(11) . . ?
Au01 Au06 Au07 57.86(2) . . ?
Au01 Au06 Au08 58.84(2) . . ?
Au01 Au06 Au09 55.92(2) . . ?
Au01 Au06 Ag0A 58.41(2) . . ?
Au01 Au06 Ag0D 59.34(3) . . ?
Au07 Au06 Au09 104.46(3) . . ?
Au07 Au06 Ag0A 59.05(3) . . ?
Au08 Au06 Au07 109.98(2) . . ?
Au08 Au06 Au09 58.04(2) . . ?
Au08 Au06 Ag0A 107.03(3) . . ?
Ag0A Au06 Au09 58.00(3) . . ?
Ag0D Au06 Au07 60.41(3) . . ?
Ag0D Au06 Au08 63.91(3) . . ?
Ag0D Au06 Au09 107.92(3) . . ?
Ag0D Au06 Ag0A 108.61(3) . . ?
P0K Au06 Au01 178.27(11) . . ?
P0K Au06 Au07 122.92(11) . . ?
P0K Au06 Au08 119.67(11) . . ?
P0K Au06 Au09 124.41(11) . . ?
P0K Au06 Ag0A 123.31(11) . . ?
P0K Au06 Ag0D 119.43(11) . . ?
Au01 Au07 Au03 58.56(2) . . ?
Au01 Au07 Au06 58.42(2) . . ?
Au01 Au07 Ag0A 59.21(3) . . ?
Au01 Au07 Ag0B 59.46(3) . . ?
Au01 Au07 Ag0D 59.09(3) . . ?
Au03 Au07 Au06 109.10(3) . . ?
Au03 Au07 Ag0D 108.78(3) . . ?
Au06 Au07 Ag0D 59.23(3) . . ?
Ag0A Au07 Au03 61.39(3) . . ?
Ag0A Au07 Au06 60.76(3) . . ?
Ag0A Au07 Ag0D 109.05(4) . . ?
Ag0B Au07 Au03 61.87(3) . . ?
Ag0B Au07 Au06 107.53(3) . . ?
Ag0B Au07 Ag0A 111.07(4) . . ?
Ag0B Au07 Ag0D 59.09(3) . . ?
P0L Au07 Au01 175.56(11) . . ?
P0L Au07 Au03 120.36(12) . . ?
P0L Au07 Au06 124.78(11) . . ?
P0L Au07 Ag0A 124.63(12) . . ?
P0L Au07 Ag0B 116.10(11) . . ?
P0L Au07 Ag0D 119.06(13) . . ?
Au01 Au08 Au05 57.992(19) . . ?
Au01 Au08 Au06 58.45(2) . . ?
Au01 Au08 Au09 57.54(2) . . ?
Au01 Au08 Ag0C 58.52(3) . . ?
Au01 Au08 Ag0D 57.10(3) . . ?
Au05 Au08 Au06 105.72(3) . . ?
Au05 Au08 Ag0C 60.08(3) . . ?
Au05 Au08 Ag0D 57.52(3) . . ?
Au06 Au08 Ag0C 110.28(3) . . ?
Au06 Au08 Ag0D 57.94(3) . . ?
Au09 Au08 Au05 107.33(3) . . ?
Au09 Au08 Au06 63.09(2) . . ?
Au09 Au08 Ag0C 60.10(3) . . ?
Au09 Au08 Ag0D 107.22(3) . . ?
Ag0C Au08 Ag0D 106.13(3) . . ?
P0I Au08 Au01 173.78(11) . . ?
P0I Au08 Au05 116.35(10) . . ?
P0I Au08 Au06 123.91(11) . . ?
P0I Au08 Au09 128.56(11) . . ?
P0I Au08 Ag0C 122.06(12) . . ?
P0I Au08 Ag0D 118.35(12) . . ?
Au01 Au09 Au04 59.25(2) . . ?
Au01 Au09 Au06 57.58(2) . . ?
Au01 Au09 Au08 59.73(2) . . ?
Au01 Au09 Ag0A 59.59(3) . . ?
Au01 Au09 Ag0C 59.80(3) . . ?
Au04 Au09 Au06 108.96(3) . . ?
Au04 Au09 Au08 110.09(3) . . ?
Au04 Au09 Ag0A 62.73(3) . . ?
Au04 Au09 Ag0C 60.19(3) . . ?
Au08 Au09 Au06 58.87(2) . . ?
Au08 Au09 Ag0A 109.13(3) . . ?
Au08 Au09 Ag0C 61.82(3) . . ?
Ag0A Au09 Au06 59.66(3) . . ?
Ag0A Au09 Ag0C 111.10(3) . . ?
Ag0C Au09 Au06 108.32(3) . . ?
P0J Au09 Au01 173.25(12) . . ?
P0J Au09 Au04 123.92(11) . . ?
P0J Au09 Au06 116.29(12) . . ?
P0J Au09 Au08 120.75(11) . . ?
P0J Au09 Ag0A 115.56(11) . . ?
P0J Au09 Ag0C 126.82(12) . . ?
Au01 Ag0A Au03 57.64(2) . . ?
Au01 Ag0A Au04 56.95(2) . . ?
Au01 Ag0A Au06 57.88(2) . . ?
Au01 Ag0A Au07 58.10(3) . . ?
Au01 Ag0A Au09 57.29(2) . . ?
Au03 Ag0A Au04 56.98(2) . . ?
Au06 Ag0A Au03 107.34(3) . . ?
Au06 Ag0A Au04 107.55(3) . . ?
Au07 Ag0A Au03 59.72(3) . . ?
Au07 Ag0A Au04 105.39(3) . . ?
Au07 Ag0A Au06 60.19(3) . . ?
Au09 Ag0A Au03 104.71(3) . . ?
Au09 Ag0A Au04 58.22(3) . . ?
Au09 Ag0A Au06 62.34(3) . . ?
Au09 Ag0A Au07 108.72(4) . . ?
Cl00 Ag0A Au01 170.9(5) . . ?
Cl00 Ag0A Au03 130.2(6) . . ?
Cl00 Ag0A Au04 121.5(4) . . ?
Cl00 Ag0A Au06 117.8(6) . . ?
Cl00 Ag0A Au07 128.2(3) . . ?
Cl00 Ag0A Au09 113.8(4) . . ?
Au01 Ag0B Au02 58.36(3) . . ?
Au01 Ag0B Au03 57.38(2) . . ?
Au01 Ag0B Au05 56.96(2) . . ?
Au01 Ag0B Au07 58.13(3) . . ?
Au01 Ag0B Ag0D 59.42(3) . . ?
Au02 Ag0B Au03 60.67(3) . . ?
Au02 Ag0B Au05 58.85(3) . . ?
Au02 Ag0B Au07 108.47(4) . . ?
Au02 Ag0B Ag0D 107.97(4) . . ?
Au05 Ag0B Au03 106.24(4) . . ?
Au07 Ag0B Au03 59.61(3) . . ?
Au07 Ag0B Au05 106.62(4) . . ?
Ag0D Ag0B Au03 108.67(4) . . ?
Ag0D Ag0B Au05 58.88(3) . . ?
Ag0D Ag0B Au07 61.21(3) . . ?
Cl4 Ag0B Au01 177.0(6) . . ?
Cl4 Ag0B Au02 124.6(6) . . ?
Cl4 Ag0B Au03 123.9(3) . . ?
Cl4 Ag0B Au05 123.5(3) . . ?
Cl4 Ag0B Au07 119.7(5) . . ?
Cl4 Ag0B Ag0D 117.9(5) . . ?
Au01 Ag0C Au02 57.68(3) . . ?
Au01 Ag0C Au04 57.67(3) . . ?
Au01 Ag0C Au05 57.03(3) . . ?
Au01 Ag0C Au08 57.34(3) . . ?
Au01 Ag0C Au09 56.47(3) . . ?
Au02 Ag0C Au04 62.19(3) . . ?
Au02 Ag0C Au05 58.81(3) . . ?
Au02 Ag0C Au08 105.94(4) . . ?
Au02 Ag0C Au09 107.13(4) . . ?
Au04 Ag0C Au05 107.53(4) . . ?
Au04 Ag0C Au08 105.93(4) . . ?
Au04 Ag0C Au09 58.74(3) . . ?
Au05 Ag0C Au08 58.43(3) . . ?
Au09 Ag0C Au05 104.43(4) . . ?
Au09 Ag0C Au08 58.09(3) . . ?
Au01 Ag0D Au05 58.07(3) . . ?
Au01 Ag0D Au06 58.34(3) . . ?
Au01 Ag0D Au07 57.54(3) . . ?
Au01 Ag0D Au08 56.55(3) . . ?
Au01 Ag0D Ag0B 59.17(3) . . ?
Au05 Ag0D Au06 106.49(4) . . ?
Au05 Ag0D Au07 108.14(4) . . ?
Au05 Ag0D Au08 58.23(3) . . ?
Au06 Ag0D Au07 60.36(3) . . ?
Au06 Ag0D Au08 58.15(3) . . ?
Au07 Ag0D Au08 105.52(4) . . ?
Ag0B Ag0D Au05 62.39(3) . . ?
Ag0B Ag0D Au06 108.93(4) . . ?
Ag0B Ag0D Au07 59.69(3) . . ?
Ag0B Ag0D Au08 107.85(4) . . ?
Cl2 Ag0D Au01 168.5(5) . . ?
Cl2 Ag0D Au05 110.9(6) . . ?
Cl2 Ag0D Au06 127.7(7) . . ?
Cl2 Ag0D Au07 133.3(4) . . ?
Cl2 Ag0D Au08 116.3(3) . . ?
Cl2 Ag0D Ag0B 120.3(6) . . ?
C012 P0E Au03 117.3(5) . . ?
C012 P0E C014 105.9(7) . . ?
C014 P0E Au03 109.8(5) . . ?
C01H P0E Au03 114.3(5) . . ?
C01H P0E C012 101.0(7) . . ?
C01H P0E C014 107.8(8) . . ?
C00Y P0F Au04 113.4(6) . . ?
C00Y P0F C027 108.6(8) . . ?
C00Y P0F C030 107.8(8) . . ?
C027 P0F Au04 115.2(5) . . ?
C030 P0F Au04 111.5(6) . . ?
C030 P0F C027 99.3(7) . . ?
C01O P0G Au02 108.3(4) . . ?
C01O P0G C03G 106.5(7) . . ?
C02D P0G Au02 114.4(5) . . ?
C02D P0G C01O 105.9(7) . . ?
C02D P0G C03G 102.7(8) . . ?
C03G P0G Au02 118.2(5) . . ?
C01D P0H Au05 111.3(5) . . ?
C01D P0H C01R 108.6(8) . . ?
C01R P0H Au05 112.9(6) . . ?
C025 P0H Au05 116.3(5) . . ?
C025 P0H C01D 106.9(8) . . ?
C025 P0H C01R 100.0(8) . . ?
C01M P0I Au08 117.2(6) . . ?
C01M P0I C01Z 106.1(9) . . ?
C01Z P0I Au08 110.8(6) . . ?
C02L P0I Au08 113.2(6) . . ?
C02L P0I C01M 103.3(9) . . ?
C02L P0I C01Z 105.3(9) . . ?
C01U P0J Au09 112.4(6) . . ?
C01U P0J C02P 106.4(8) . . ?
C01W P0J Au09 115.9(6) . . ?
C01W P0J C01U 110.8(8) . . ?
C01W P0J C02P 102.4(8) . . ?
C02P P0J Au09 108.0(6) . . ?
C020 P0K Au06 115.9(5) . . ?
C020 P0K C04A 101.6(8) . . ?
C02I P0K Au06 115.5(6) . . ?
C02I P0K C020 106.0(8) . . ?
C02I P0K C04A 102.4(9) . . ?
C04A P0K Au06 113.7(6) . . ?
C01V P0L Au07 112.2(6) . . ?
C01V P0L C02V 111.0(11) . . ?
C02V P0L Au07 112.2(9) . . ?
C02X P0L Au07 115.8(6) . . ?
C02X P0L C01V 102.4(9) . . ?
C02X P0L C02V 102.5(11) . . ?
C017 C00Y P0F 121.2(14) . . ?
C017 C00Y C02C 119.0(16) . . ?
C02C C00Y P0F 119.8(13) . . ?
C014 C011 C01C 117.2(15) . . ?
C013 C012 P0E 122.5(13) . . ?
C01S C012 P0E 118.5(14) . . ?
C01S C012 C013 119.0(17) . . ?
C02F C013 C012 118.7(19) . . ?
C011 C014 P0E 113.4(11) . . ?
C019 C016 C027 115.0(13) . . ?
C00Y C017 C02M 122(2) . . ?
C01O C019 C016 110.6(12) . . ?
C022 C01B C02I 119.3(19) . . ?
C011 C01C C02X 112.0(15) . . ?
C01L C01D P0H 116.1(13) . . ?
C01L C01D C02O 122.3(16) . . ?
C02O C01D P0H 121.6(13) . . ?
C01Z C01E C01I 114.2(17) . . ?
C02Q C01F C01L 120.1(16) . . ?
C02E C01G C02K 122.4(18) . . ?
C01Y C01H P0E 119.0(13) . . ?
C03X C01H P0E 120.5(13) . . ?
C03X C01H C01Y 120.5(15) . . ?
C01E C01I C025 110.1(16) . . ?
C023 C01K C02A 118.6(17) . . ?
C01D C01L C01F 118.5(15) . . ?
C02R C01M P0I 122.5(19) . . ?
C02R C01M C039 118(2) . . ?
C039 C01M P0I 119.3(16) . . ?
C019 C01O P0G 111.5(9) . . ?
C021 C01P C03S 118.9(19) . . ?
C72 C01Q C01U 123(2) . . ?
C01X C01R P0H 119.4(13) . . ?
C01X C01R C02K 119.9(17) . . ?
C02K C01R P0H 120.8(14) . . ?
C012 C01S C02G 120.2(19) . . ?
C030 C01T C02H 119.7(18) . . ?
C01Q C01U P0J 123.1(15) . . ?
C029 C01U P0J 122.4(14) . . ?
C029 C01U C01Q 114.5(17) . . ?
C036 C01V P0L 118.1(16) . . ?
C51 C01V P0L 125.6(18) . . ?
C51 C01V C036 116(2) . . ?
C02B C01W P0J 121.1(13) . . ?
C02B C01W C03A 113.6(15) . . ?
C03A C01W P0J 124.9(14) . . ?
C01R C01X C03K 120.7(18) . . ?
C02Z C01Y C01H 121.0(19) . . ?
C01E C01Z P0I 114.1(12) . . ?
C03R C020 P0K 119.5(13) . . ?
C032 C021 C01P 122.8(17) . . ?
C01B C022 C03B 123(2) . . ?
C02D C023 C01K 123.2(17) . . ?
C02G C024 C02F 119.7(18) . . ?
C01I C025 P0H 114.3(11) . . ?
C02B C026 C034 119(2) . . ?
C016 C027 P0F 118.2(11) . . ?
C043 C028 C02D 121.2(17) . . ?
C02Y C029 C01U 122.7(19) . . ?
C043 C02A C01K 118.4(16) . . ?
C026 C02B C01W 122.2(19) . . ?
C037 C02C C00Y 118.9(17) . . ?
C023 C02D P0G 125.3(13) . . ?
C023 C02D C028 116.5(15) . . ?
C028 C02D P0G 118.1(11) . . ?
C01G C02E C03K 120.3(19) . . ?
C013 C02F C024 122.9(19) . . ?
C024 C02G C01S 119.5(19) . . ?
C038 C02H C01T 124(2) . . ?
C01B C02I P0K 116.8(15) . . ?
C03C C02I P0K 124.0(15) . . ?
C03C C02I C01B 119(2) . . ?
C03G C02J C032 120.9(17) . . ?
C01G C02K C01R 117.6(19) . . ?
C02S C02L P0I 120.4(13) . . ?
C02S C02L C02W 118.3(19) . . ?
C02W C02L P0I 121.3(17) . . ?
C031 C02M C017 119(2) . . ?
C01D C02O C02T 118.5(17) . . ?
C033 C02P P0J 109.8(13) . . ?
C02T C02Q C01F 120.0(17) . . ?
C03N C02R C01M 118(3) . . ?
C02L C02S C045 121.3(17) . . ?
C02Q C02T C02O 120.4(18) . . ?
C03L C02V P0L 116(2) . . ?
C03T C02V P0L 121.8(19) . . ?
C03T C02V C03L 122(2) . . ?
C62 C02W C02L 122(2) . . ?
C01C C02X P0L 112.1(12) . . ?
C029 C02Y C65 119(2) . . ?
C01Y C02Z C03J 119(2) . . ?
C01T C030 P0F 118.8(14) . . ?
C01T C030 C03M 120.3(16) . . ?
C03M C030 P0F 120.8(14) . . ?
C02M C031 C037 120.0(17) . . ?
C021 C032 C02J 116.7(19) . . ?
C03R C033 C02P 109.7(16) . . ?
C044 C034 C026 122(2) . . ?
C03Z C035 C04A 122(2) . . ?
C01V C036 C19 121(2) . . ?
C02C C037 C031 120.5(18) . . ?
C02H C038 C03O 117.1(19) . . ?
C03Q C039 C01M 120(3) . . ?
C044 C03A C01W 124(2) . . ?
C03E C03B C022 115(2) . . ?
C02I C03C C03E 120.2(19) . . ?
C03N C03D C03Q 117(2) . . ?
C03B C03E C03C 122.9(19) . . ?
C02J C03G P0G 120.5(13) . . ?
C02J C03G C03S 120.9(16) . . ?
C03S C03G P0G 118.3(14) . . ?
C39 C03J C02Z 118.5(19) . . ?
C02E C03K C01X 119(2) . . ?
C02V C03L C43 110(3) . . ?
C030 C03M C03O 116.7(18) . . ?
C03D C03N C02R 127(3) . . ?
C038 C03O C03M 122(2) . . ?
C04A C03P C040 119(3) . . ?
C039 C03Q C03D 120(3) . . ?
C033 C03R C020 117.9(16) . . ?
C03G C03S C01P 119.5(19) . . ?
C02V C03T C86 121(3) . . ?
C040 C03W C03Z 119(2) . . ?
C01H C03X C39 116.8(18) . . ?
C035 C03Z C03W 118(2) . . ?
C03W C040 C03P 121(3) . . ?
C028 C043 C02A 121.6(19) . . ?
C03A C044 C034 119(2) . . ?
C35 C045 C02S 117(2) . . ?
C035 C04A P0K 117.4(16) . . ?
C03P C04A P0K 121.9(18) . . ?
C03P C04A C035 121(2) . . ?
C44 C19 C036 120(3) . . ?
C045 C35 C62 123(2) . . ?
C03J C39 C03X 124(2) . . ?
C131 C43 C03L 123(2) . . ?
C19 C44 C40 116(3) . . ?
C01V C51 C40 126(3) . . ?
C02W C62 C35 118(2) . . ?
C72 C65 C02Y 119.1(19) . . ?
C01Q C72 C65 121(2) . . ?
C131 C86 C03T 122(3) . . ?
C86 C131 C43 120(3) . . ?
C51 C40 C44 119(3) . . ?
Cl1 C47 Cl0M 119.7(17) . . ?
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
Au01 Au02 2.7493(7) . ?
Au01 Au03 2.7673(8) . ?
Au01 Au04 2.7538(8) . ?
Au01 Au05 2.7433(8) . ?
Au01 Au06 2.7662(8) . ?
Au01 Au07 2.7493(8) . ?
Au01 Au08 2.7777(8) . ?
Au01 Au09 2.7140(8) . ?
Au01 Ag0A 2.7819(11) . ?
Au01 Ag0B 2.7881(11) . ?
Au01 Ag0C 2.8139(12) . ?
Au01 Ag0D 2.7954(12) . ?
Au02 Au03 2.9396(8) . ?
Au02 Au04 2.9843(8) . ?
Au02 Au05 2.8539(8) . ?
Au02 Ag0B 2.8495(12) . ?
Au02 Ag0C 2.8841(12) . ?
Au02 P0G 2.299(4) . ?
Au03 Au04 2.8300(9) . ?
Au03 Au07 2.9024(9) . ?
Au03 Ag0A 2.9506(11) . ?
Au03 Ag0B 2.9672(12) . ?
Au03 P0E 2.305(4) . ?
Au04 Au09 2.8518(9) . ?
Au04 Ag0A 2.9820(12) . ?
Au04 Ag0C 2.8945(12) . ?
Au04 P0F 2.296(4) . ?
Au05 Au08 2.8786(8) . ?
Au05 Ag0B 2.9561(12) . ?
Au05 Ag0C 2.9284(12) . ?
Au05 Ag0D 2.8561(13) . ?
Au05 P0H 2.297(4) . ?
Au06 Au07 2.9114(9) . ?
Au06 Au08 2.8847(9) . ?
Au06 Au09 3.0050(10) . ?
Au06 Ag0A 2.9281(12) . ?
Au06 Ag0D 2.8780(12) . ?
Au06 P0K 2.314(4) . ?
Au07 Ag0A 2.8777(12) . ?
Au07 Ag0B 2.8691(11) . ?
Au07 Ag0D 2.9126(12) . ?
Au07 P0L 2.298(4) . ?
Au08 Au09 2.8589(9) . ?
Au08 Ag0C 2.9688(13) . ?
Au08 Ag0D 3.0497(14) . ?
Au08 P0I 2.322(4) . ?
Au09 Ag0A 2.8772(12) . ?
Au09 Ag0C 2.9198(12) . ?
Au09 P0J 2.288(4) . ?
Ag0A Cl00 2.545(18) . ?
Ag0B Ag0D 2.8514(15) . ?
Ag0B Cl4 2.459(14) . ?
Ag0C Cl3 2.548(9) . ?
Ag0D Cl2 2.56(2) . ?
P0E C012 1.826(17) . ?
P0E C014 1.831(17) . ?
P0E C01H 1.825(15) . ?
P0F C00Y 1.781(15) . ?
P0F C027 1.828(16) . ?
P0F C030 1.819(17) . ?
P0G C01O 1.820(13) . ?
P0G C02D 1.788(16) . ?
P0G C03G 1.827(17) . ?
P0H C01D 1.833(18) . ?
P0H C01R 1.836(17) . ?
P0H C025 1.826(15) . ?
P0I C01M 1.812(18) . ?
P0I C01Z 1.83(2) . ?
P0I C02L 1.795(19) . ?
P0J C01U 1.784(18) . ?
P0J C01W 1.742(17) . ?
P0J C02P 1.823(19) . ?
P0K C020 1.813(17) . ?
P0K C02I 1.80(2) . ?
P0K C04A 1.83(2) . ?
P0L C01V 1.843(19) . ?
P0L C02V 1.84(2) . ?
P0L C02X 1.829(18) . ?
Cl0M C47 1.656(10) . ?
Cl1 C47 1.653(10) . ?
C00Y C017 1.34(2) . ?
C00Y C02C 1.47(2) . ?
C011 C014 1.52(2) . ?
C011 C01C 1.52(2) . ?
C012 C013 1.41(2) . ?
C012 C01S 1.35(2) . ?
C013 C02F 1.34(2) . ?
C016 C019 1.54(2) . ?
C016 C027 1.54(2) . ?
C017 C02M 1.43(3) . ?
C019 C01O 1.515(19) . ?
C01B C022 1.34(3) . ?
C01B C02I 1.40(3) . ?
C01C C02X 1.54(3) . ?
C01D C01L 1.38(2) . ?
C01D C02O 1.38(2) . ?
C01E C01I 1.53(2) . ?
C01E C01Z 1.52(3) . ?
C01F C01L 1.42(2) . ?
C01F C02Q 1.41(3) . ?
C01G C02E 1.34(3) . ?
C01G C02K 1.39(3) . ?
C01H C01Y 1.39(2) . ?
C01H C03X 1.37(3) . ?
C01I C025 1.54(3) . ?
C01K C023 1.39(2) . ?
C01K C02A 1.45(3) . ?
C01M C02R 1.40(3) . ?
C01M C039 1.42(3) . ?
C01P C021 1.38(3) . ?
C01P C03S 1.40(3) . ?
C01Q C01U 1.44(2) . ?
C01Q C72 1.26(3) . ?
C01R C01X 1.34(3) . ?
C01R C02K 1.41(2) . ?
C01S C02G 1.45(3) . ?
C01T C02H 1.38(3) . ?
C01T C030 1.36(2) . ?
C01U C029 1.40(3) . ?
C01V C036 1.36(3) . ?
C01V C51 1.29(3) . ?
C01W C02B 1.46(2) . ?
C01W C03A 1.47(2) . ?
C01X C03K 1.43(3) . ?
C01Y C02Z 1.34(3) . ?
C020 C03R 1.55(3) . ?
C021 C032 1.37(3) . ?
C022 C03B 1.44(3) . ?
C023 C02D 1.37(2) . ?
C024 C02F 1.38(3) . ?
C024 C02G 1.31(3) . ?
C026 C02B 1.33(3) . ?
C026 C034 1.44(4) . ?
C028 C02D 1.45(2) . ?
C028 C043 1.36(3) . ?
C029 C02Y 1.30(3) . ?
C02A C043 1.37(3) . ?
C02C C037 1.35(3) . ?
C02E C03K 1.36(3) . ?
C02H C038 1.32(3) . ?
C02I C03C 1.37(3) . ?
C02J C032 1.42(2) . ?
C02J C03G 1.36(2) . ?
C02L C02S 1.37(3) . ?
C02L C02W 1.38(3) . ?
C02M C031 1.36(3) . ?
C02O C02T 1.44(3) . ?
C02P C033 1.53(3) . ?
C02Q C02T 1.35(3) . ?
C02R C03N 1.36(3) . ?
C02S C045 1.43(3) . ?
C02V C03L 1.46(3) . ?
C02V C03T 1.29(4) . ?
C02W C62 1.33(4) . ?
C02Y C65 1.44(3) . ?
C02Z C03J 1.49(4) . ?
C030 C03M 1.40(3) . ?
C031 C037 1.43(3) . ?
C033 C03R 1.48(3) . ?
C034 C044 1.37(4) . ?
C035 C03Z 1.37(3) . ?
C035 C04A 1.41(3) . ?
C036 C19 1.36(3) . ?
C038 C03O 1.39(3) . ?
C039 C03Q 1.34(3) . ?
C03A C044 1.30(3) . ?
C03B C03E 1.35(3) . ?
C03C C03E 1.38(3) . ?
C03D C03N 1.25(4) . ?
C03D C03Q 1.47(5) . ?
C03G C03S 1.37(2) . ?
C03J C39 1.26(4) . ?
C03L C43 1.48(3) . ?
C03M C03O 1.42(3) . ?
C03P C040 1.43(3) . ?
C03P C04A 1.31(3) . ?
C03T C86 1.43(3) . ?
C03W C03Z 1.40(3) . ?
C03W C040 1.37(4) . ?
C03X C39 1.45(3) . ?
C045 C35 1.31(3) . ?
C19 C44 1.35(4) . ?
C35 C62 1.44(4) . ?
C43 C131 1.36(4) . ?
C44 C40 1.41(4) . ?
C51 C40 1.30(4) . ?
C65 C72 1.35(3) . ?
C86 C131 1.24(4) . ?
