#------------------------------------------------------------------------------
#$Date: 2017-09-30 06:02:35 +0300 (Sat, 30 Sep 2017) $
#$Revision: 201542 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/43/7044370.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_7044370
loop_
_publ_author_name
'Hau, Sam Chunkit'
'Mak, Thomas C. W.'
_publ_section_title
;
 Assembly of high-symmetry silver(I) alkyl-1,3-diynyl cluster complexes
 via core transformation
;
_journal_name_full               'Dalton Trans.'
_journal_paper_doi               10.1039/C7DT03406G
_journal_year                    2017
_chemical_formula_moiety
'C204 H186 Ag8 P8, 2(Cl O4), 2(C4 H10 O), 2(C H2 Cl2)'
_chemical_formula_sum            'C214 H210 Ag8 Cl6 O10 P8'
_chemical_formula_weight         4265.23
_chemical_name_systematic
;
 ? 
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_date             2017-09-25
_audit_creation_method
;
Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
;
_audit_update_record
;
2017-09-25 deposited with the CCDC.
2017-09-29 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 109.178(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   36.107(3)
_cell_length_b                   30.577(3)
_cell_length_c                   18.5765(16)
_cell_measurement_reflns_used    9887
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      27.845
_cell_measurement_theta_min      2.235
_cell_volume                     19371(3)
_computing_cell_refinement       'SAINT v7.68A (Bruker, 2009)'
_computing_data_collection       APEX2(Bruker,2003)
_computing_data_reduction        'SAINT v7.68A (Bruker, 2009)'
_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    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      173.15
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1127
_diffrn_reflns_av_unetI/netI     0.0434
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_limit_h_max       43
_diffrn_reflns_limit_h_min       -43
_diffrn_reflns_limit_k_max       36
_diffrn_reflns_limit_k_min       -36
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            265544
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.250
_diffrn_reflns_theta_min         1.301
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.998
_exptl_absorpt_correction_T_max  0.7539
_exptl_absorpt_correction_T_min  0.6352
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            'clear light colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.462
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             8688
_exptl_crystal_size_max          0.5
_exptl_crystal_size_mid          0.4
_exptl_crystal_size_min          0.3
_refine_diff_density_max         1.870
_refine_diff_density_min         -1.245
_refine_diff_density_rms         0.140
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.132
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1084
_refine_ls_number_reflns         17573
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.132
_refine_ls_R_factor_all          0.0677
_refine_ls_R_factor_gt           0.0539
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0800P)²+142.8018P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1414
_refine_ls_wR_factor_ref         0.1638
_reflns_Friedel_coverage         0.000
_reflns_number_gt                14687
_reflns_number_total             17573
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c7dt03406g2.cif
_cod_data_source_block           2
_cod_database_code               7044370
_shelx_shelxl_version_number     2014/7
_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_max   0.754
_shelx_estimated_absorpt_t_min   0.635
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C5(H5), C15(H15), C25(H25)
2.b Secondary CH2 refined with riding coordinates:
 C6(H6A,H6B), C7(H7A,H7B), C8(H8A,H8B), C9(H9A,H9B), C10(H10A,H10B), C16(H16A,
 H16B), C17(H17A,H17B), C18(H18A,H18B), C19(H19A,H19B), C20(H20A,H20B),
 C26(H26A,H26B), C27(H27A,H27B), C28(H28A,H28B), C29(H29A,H29B), C30(H30A,H30B),
  C105(H10F,H10G), C106(H10H,H10I), C103(H10M,H10N)
2.c Me refined with riding coordinates:
 C104(H10C,H10D,H10E), C107(H10J,H10K,H10L)
2.d Aromatic/amide H refined with riding coordinates:
 C32(H32), C33(H33), C34(H34), C35(H35), C36(H36), C38(H38), C39(H39),
 C40(H40), C41(H41), C42(H42), C44(H44), C45(H45), C46(H46), C47(H47), C48(H48),
  C50(H50), C51(H51), C52(H52), C53(H53), C54(H54), C56(H56), C57(H57),
 C58(H58), C59(H59), C60(H60), C62(H62), C63(H63), C64(H64), C65(H65), C66(H66),
  C68(H68), C69(H69), C70(H70), C71(H71), C72(H72), C74(H74), C75(H75),
 C76(H76), C77(H77), C78(H78), C80(H80), C81(H81), C82(H82), C83(H83), C84(H84),
  C86(H86), C87(H87), C88(H88), C89(H89), C90(H90), C92(H92), C93(H93),
 C94(H94), C95(H95), C96(H96), C98(H98), C99(H99), C100(H100), C101(H101),
 C102(H102)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, 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
Ag1 Ag 0.50901(2) 0.28353(2) 0.17451(2) 0.02521(11) Uani 1 1 d . . .
Ag2 Ag 0.5000 0.19382(2) 0.2500 0.02997(14) Uani 1 2 d S T P
Ag3 Ag 0.57673(2) 0.25491(2) 0.32627(2) 0.02656(11) Uani 1 1 d . . .
Ag4 Ag 0.52024(2) 0.19405(2) 0.07412(2) 0.02782(11) Uani 1 1 d . . .
Ag5 Ag 0.5000 0.38382(2) 0.2500 0.02682(13) Uani 1 2 d S T P
P1 P 0.64863(4) 0.25316(4) 0.39723(7) 0.0229(3) Uani 1 1 d . . .
P2 P 0.50799(4) 0.11280(4) 0.04889(7) 0.0252(3) Uani 1 1 d . . .
P3 P 0.54295(4) 0.23431(4) -0.02159(8) 0.0287(3) Uani 1 1 d . . .
P4 P 0.49942(4) 0.43007(4) 0.13874(7) 0.0275(3) Uani 1 1 d . . .
Cl1 Cl 0.65365(6) 0.37867(10) -0.19216(12) 0.0861(8) Uani 1 1 d . . .
C1 C 0.55077(14) 0.32213(16) 0.2535(3) 0.0262(10) Uani 1 1 d . . .
C2 C 0.57360(14) 0.34466(15) 0.3029(3) 0.0263(10) Uani 1 1 d . . .
C3 C 0.59912(16) 0.37074(17) 0.3574(3) 0.0335(12) Uani 1 1 d . . .
C4 C 0.62009(19) 0.3950(2) 0.4052(4) 0.0460(15) Uani 1 1 d . . .
C5 C 0.64214(19) 0.4270(2) 0.4635(4) 0.0485(15) Uani 1 1 d . . .
H5 H 0.6229 0.4455 0.4780 0.058 Uiso 1 1 calc R . .
C6 C 0.6689(2) 0.4052(2) 0.5340(4) 0.0543(17) Uani 1 1 d . . .
H6A H 0.6877 0.3861 0.5204 0.065 Uiso 1 1 calc R . .
H6B H 0.6532 0.3869 0.5572 0.065 Uiso 1 1 calc R . .
C7 C 0.6912(2) 0.4397(3) 0.5911(4) 0.0582(18) Uani 1 1 d . . .
H7A H 0.6724 0.4563 0.6092 0.070 Uiso 1 1 calc R . .
H7B H 0.7099 0.4249 0.6357 0.070 Uiso 1 1 calc R . .
C8 C 0.7133(3) 0.4711(3) 0.5572(5) 0.074(2) Uani 1 1 d . . .
H8A H 0.7255 0.4940 0.5952 0.088 Uiso 1 1 calc R . .
H8B H 0.7347 0.4550 0.5461 0.088 Uiso 1 1 calc R . .
C9 C 0.6880(3) 0.4920(3) 0.4865(5) 0.071(2) Uani 1 1 d . . .
H9A H 0.7041 0.5104 0.4647 0.086 Uiso 1 1 calc R . .
H9B H 0.6685 0.5110 0.4983 0.086 Uiso 1 1 calc R . .
C10 C 0.6664(2) 0.4570(2) 0.4279(4) 0.0588(19) Uani 1 1 d . . .
H10A H 0.6857 0.4392 0.4132 0.071 Uiso 1 1 calc R . .
H10B H 0.6488 0.4714 0.3815 0.071 Uiso 1 1 calc R . .
C11 C 0.46747(14) 0.24521(16) 0.0944(3) 0.0257(10) Uani 1 1 d . . .
C12 C 0.44325(15) 0.22099(16) 0.0520(3) 0.0269(10) Uani 1 1 d . . .
C13 C 0.41520(15) 0.19343(17) 0.0042(3) 0.0299(11) Uani 1 1 d . . .
C14 C 0.39041(16) 0.17007(19) -0.0356(3) 0.0369(12) Uani 1 1 d . . .
C15 C 0.35856(16) 0.14234(18) -0.0848(4) 0.0385(13) Uani 1 1 d . . .
H15 H 0.3332 0.1559 -0.0859 0.046 Uiso 1 1 calc R . .
C16 C 0.35972(19) 0.0961(2) -0.0524(4) 0.0491(16) Uani 1 1 d . . .
H16A H 0.3583 0.0977 -0.0001 0.059 Uiso 1 1 calc R . .
H16B H 0.3847 0.0817 -0.0497 0.059 Uiso 1 1 calc R . .
C17 C 0.3251(2) 0.0693(2) -0.1033(5) 0.0570(19) Uani 1 1 d . . .
H17A H 0.3269 0.0390 -0.0835 0.068 Uiso 1 1 calc R . .
H17B H 0.3003 0.0821 -0.1016 0.068 Uiso 1 1 calc R . .
C18 C 0.3248(2) 0.0683(3) -0.1837(5) 0.068(2) Uani 1 1 d . . .
H18A H 0.3013 0.0521 -0.2152 0.081 Uiso 1 1 calc R . .
H18B H 0.3482 0.0523 -0.1859 0.081 Uiso 1 1 calc R . .
C19 C 0.3245(2) 0.1134(3) -0.2164(5) 0.068(2) Uani 1 1 d . . .
H19A H 0.2994 0.1280 -0.2207 0.082 Uiso 1 1 calc R . .
H19B H 0.3264 0.1110 -0.2682 0.082 Uiso 1 1 calc R . .
C20 C 0.3589(2) 0.1413(2) -0.1660(4) 0.0502(16) Uani 1 1 d . . .
H20A H 0.3841 0.1289 -0.1670 0.060 Uiso 1 1 calc R . .
H20B H 0.3567 0.1715 -0.1863 0.060 Uiso 1 1 calc R . .
C21 C 0.55185(16) 0.19532(16) 0.2243(3) 0.0324(12) Uani 1 1 d . . .
C22 C 0.58209(15) 0.19970(16) 0.2079(3) 0.0286(11) Uani 1 1 d . . .
C23 C 0.61693(17) 0.20299(19) 0.1925(3) 0.0378(13) Uani 1 1 d . . .
C24 C 0.6472(2) 0.2065(2) 0.1809(4) 0.0482(15) Uani 1 1 d . . .
C25 C 0.6856(2) 0.2113(3) 0.1695(5) 0.064(2) Uani 1 1 d . . .
H25 H 0.7046 0.2209 0.2195 0.076 Uiso 1 1 calc R . .
C26 C 0.6999(2) 0.1681(3) 0.1511(5) 0.069(2) Uani 1 1 d . . .
H26A H 0.6808 0.1562 0.1039 0.083 Uiso 1 1 calc R . .
H26B H 0.7020 0.1472 0.1930 0.083 Uiso 1 1 calc R . .
C27 C 0.7398(3) 0.1726(4) 0.1402(8) 0.108(4) Uani 1 1 d . . .
H27A H 0.7598 0.1799 0.1897 0.129 Uiso 1 1 calc R . .
H27B H 0.7472 0.1442 0.1230 0.129 Uiso 1 1 calc R . .
C28 C 0.7399(4) 0.2063(5) 0.0848(9) 0.139(6) Uani 1 1 d . . .
H28A H 0.7234 0.1963 0.0336 0.167 Uiso 1 1 calc R . .
H28B H 0.7669 0.2099 0.0839 0.167 Uiso 1 1 calc R . .
C29 C 0.7247(4) 0.2506(4) 0.1008(9) 0.112(4) Uani 1 1 d . . .
H29A H 0.7439 0.2638 0.1467 0.134 Uiso 1 1 calc R . .
H29B H 0.7218 0.2705 0.0572 0.134 Uiso 1 1 calc R . .
C30 C 0.6857(3) 0.2457(3) 0.1134(7) 0.096(4) Uani 1 1 d . . .
H30A H 0.6785 0.2739 0.1312 0.115 Uiso 1 1 calc R . .
H30B H 0.6654 0.2386 0.0641 0.115 Uiso 1 1 calc R . .
C31 C 0.66249(14) 0.25922(16) 0.5003(3) 0.0252(10) Uani 1 1 d . . .
C32 C 0.69298(15) 0.23591(17) 0.5514(3) 0.0300(11) Uani 1 1 d . . .
H32 H 0.7078 0.2159 0.5328 0.036 Uiso 1 1 calc R . .
C33 C 0.70190(17) 0.2417(2) 0.6293(3) 0.0390(13) Uani 1 1 d . . .
H33 H 0.7224 0.2251 0.6636 0.047 Uiso 1 1 calc R . .
C34 C 0.68166(19) 0.2710(2) 0.6573(3) 0.0451(14) Uani 1 1 d . . .
H34 H 0.6882 0.2750 0.7108 0.054 Uiso 1 1 calc R . .
C35 C 0.65157(19) 0.2949(2) 0.6075(4) 0.0460(15) Uani 1 1 d . . .
H35 H 0.6378 0.3157 0.6269 0.055 Uiso 1 1 calc R . .
C36 C 0.64134(17) 0.28868(18) 0.5298(3) 0.0347(12) Uani 1 1 d . . .
H36 H 0.6199 0.3044 0.4962 0.042 Uiso 1 1 calc R . .
C37 C 0.67723(14) 0.29583(16) 0.3706(3) 0.0260(10) Uani 1 1 d . . .
C38 C 0.70835(15) 0.31729(17) 0.4230(3) 0.0329(11) Uani 1 1 d . . .
H38 H 0.7157 0.3098 0.4755 0.040 Uiso 1 1 calc R . .
C39 C 0.72861(17) 0.34917(19) 0.3999(4) 0.0418(14) Uani 1 1 d . . .
H39 H 0.7500 0.3634 0.4365 0.050 Uiso 1 1 calc R . .
C40 C 0.71853(18) 0.3607(2) 0.3250(4) 0.0469(15) Uani 1 1 d . . .
H40 H 0.7326 0.3831 0.3096 0.056 Uiso 1 1 calc R . .
C41 C 0.6878(2) 0.3398(2) 0.2716(4) 0.0534(17) Uani 1 1 d . . .
H41 H 0.6812 0.3473 0.2193 0.064 Uiso 1 1 calc R . .
C42 C 0.66658(17) 0.30769(18) 0.2937(3) 0.0369(13) Uani 1 1 d . . .
H42 H 0.6450 0.2939 0.2569 0.044 Uiso 1 1 calc R . .
C43 C 0.67323(14) 0.20251(16) 0.3857(3) 0.0256(10) Uani 1 1 d . . .
C44 C 0.65249(16) 0.16333(17) 0.3812(3) 0.0343(12) Uani 1 1 d . . .
H44 H 0.6267 0.1636 0.3842 0.041 Uiso 1 1 calc R . .
C45 C 0.66969(19) 0.12446(19) 0.3723(4) 0.0452(15) Uani 1 1 d . . .
H45 H 0.6559 0.0978 0.3707 0.054 Uiso 1 1 calc R . .
C46 C 0.70673(19) 0.1237(2) 0.3659(4) 0.0473(15) Uani 1 1 d . . .
H46 H 0.7181 0.0967 0.3590 0.057 Uiso 1 1 calc R . .
C47 C 0.72701(17) 0.1620(2) 0.3694(4) 0.0442(14) Uani 1 1 d . . .
H47 H 0.7525 0.1617 0.3648 0.053 Uiso 1 1 calc R . .
C48 C 0.71010(16) 0.20122(18) 0.3797(3) 0.0344(12) Uani 1 1 d . . .
H48 H 0.7243 0.2277 0.3827 0.041 Uiso 1 1 calc R . .
C49 C 0.48316(15) 0.08387(16) 0.1056(3) 0.0273(10) Uani 1 1 d . . .
C50 C 0.45813(15) 0.10714(17) 0.1338(3) 0.0299(11) Uani 1 1 d . . .
H50 H 0.4548 0.1377 0.1243 0.036 Uiso 1 1 calc R . .
C51 C 0.43772(17) 0.0863(2) 0.1763(3) 0.0381(13) Uani 1 1 d . . .
H51 H 0.4208 0.1026 0.1960 0.046 Uiso 1 1 calc R . .
C52 C 0.44220(18) 0.0419(2) 0.1894(3) 0.0433(14) Uani 1 1 d . . .
H52 H 0.4282 0.0276 0.2179 0.052 Uiso 1 1 calc R . .
C53 C 0.46696(19) 0.01826(19) 0.1612(3) 0.0416(13) Uani 1 1 d . . .
H53 H 0.4700 -0.0123 0.1704 0.050 Uiso 1 1 calc R . .
C54 C 0.48739(17) 0.03887(17) 0.1197(3) 0.0341(12) Uani 1 1 d . . .
H54 H 0.5044 0.0224 0.1006 0.041 Uiso 1 1 calc R . .
C55 C 0.55466(15) 0.08372(16) 0.0695(3) 0.0286(11) Uani 1 1 d . . .
C56 C 0.58405(17) 0.09288(17) 0.1376(3) 0.0368(13) Uani 1 1 d . . .
H56 H 0.5791 0.1129 0.1725 0.044 Uiso 1 1 calc R . .
C57 C 0.62063(18) 0.0731(2) 0.1553(4) 0.0489(16) Uani 1 1 d . . .
H57 H 0.6405 0.0794 0.2023 0.059 Uiso 1 1 calc R . .
C58 C 0.62812(19) 0.0443(2) 0.1047(4) 0.0499(16) Uani 1 1 d . . .
H58 H 0.6531 0.0308 0.1170 0.060 Uiso 1 1 calc R . .
C59 C 0.59941(19) 0.0350(2) 0.0362(4) 0.0467(15) Uani 1 1 d . . .
H59 H 0.6047 0.0153 0.0012 0.056 Uiso 1 1 calc R . .
C60 C 0.56261(17) 0.05460(18) 0.0186(3) 0.0354(12) Uani 1 1 d . . .
H60 H 0.5428 0.0481 -0.0283 0.042 Uiso 1 1 calc R . .
C61 C 0.48125(15) 0.09550(16) -0.0491(3) 0.0277(10) Uani 1 1 d . . .
C62 C 0.45635(15) 0.05979(17) -0.0669(3) 0.0313(11) Uani 1 1 d . . .
H62 H 0.4514 0.0436 -0.0274 0.038 Uiso 1 1 calc R . .
C63 C 0.43838(16) 0.04744(19) -0.1432(3) 0.0376(13) Uani 1 1 d . . .
H63 H 0.4210 0.0232 -0.1550 0.045 Uiso 1 1 calc R . .
C64 C 0.44565(19) 0.0699(2) -0.2005(3) 0.0433(14) Uani 1 1 d . . .
H64 H 0.4335 0.0613 -0.2521 0.052 Uiso 1 1 calc R . .
C65 C 0.4709(2) 0.1054(2) -0.1831(3) 0.0485(16) Uani 1 1 d . . .
H65 H 0.4760 0.1210 -0.2230 0.058 Uiso 1 1 calc R . .
C66 C 0.48873(18) 0.1183(2) -0.1080(3) 0.0404(13) Uani 1 1 d . . .
H66 H 0.5060 0.1427 -0.0967 0.049 Uiso 1 1 calc R . .
C67 C 0.50083(16) 0.25577(18) -0.0985(3) 0.0325(11) Uani 1 1 d . . .
C68 C 0.5019(2) 0.2934(2) -0.1403(3) 0.0427(14) Uani 1 1 d . . .
H68 H 0.5257 0.3092 -0.1302 0.051 Uiso 1 1 calc R . .
C69 C 0.4682(2) 0.3078(2) -0.1966(4) 0.0491(16) Uani 1 1 d . . .
H69 H 0.4694 0.3330 -0.2258 0.059 Uiso 1 1 calc R . .
C70 C 0.4332(2) 0.2859(2) -0.2106(4) 0.0489(16) Uani 1 1 d . . .
H70 H 0.4102 0.2962 -0.2488 0.059 Uiso 1 1 calc R . .
C71 C 0.43128(19) 0.2491(2) -0.1692(4) 0.0441(14) Uani 1 1 d . . .
H71 H 0.4071 0.2340 -0.1785 0.053 Uiso 1 1 calc R . .
C72 C 0.46515(17) 0.23402(19) -0.1134(3) 0.0369(12) Uani 1 1 d . . .
H72 H 0.4639 0.2085 -0.0851 0.044 Uiso 1 1 calc R . .
C73 C 0.57708(16) 0.28035(17) 0.0058(3) 0.0313(11) Uani 1 1 d . . .
C74 C 0.60054(19) 0.2934(2) -0.0360(4) 0.0443(14) Uani 1 1 d . . .
H74 H 0.5997 0.2776 -0.0805 0.053 Uiso 1 1 calc R . .
C75 C 0.6253(2) 0.3292(2) -0.0138(4) 0.0530(17) Uani 1 1 d . . .
H75 H 0.6417 0.3376 -0.0423 0.064 Uiso 1 1 calc R . .
C76 C 0.6258(2) 0.3524(2) 0.0495(4) 0.0498(16) Uani 1 1 d . . .
H76 H 0.6420 0.3775 0.0639 0.060 Uiso 1 1 calc R . .
C77 C 0.60293(18) 0.33976(19) 0.0928(4) 0.0451(15) Uani 1 1 d . . .
H77 H 0.6039 0.3556 0.1374 0.054 Uiso 1 1 calc R . .
C78 C 0.57832(17) 0.30340(19) 0.0701(3) 0.0367(12) Uani 1 1 d . . .
H78 H 0.5624 0.2946 0.0993 0.044 Uiso 1 1 calc R . .
C79 C 0.56844(17) 0.19787(17) -0.0683(3) 0.0325(11) Uani 1 1 d . . .
C80 C 0.59369(18) 0.16749(19) -0.0232(3) 0.0394(13) Uani 1 1 d . . .
H80 H 0.5963 0.1653 0.0292 0.047 Uiso 1 1 calc R . .
C81 C 0.6154(2) 0.1400(2) -0.0534(4) 0.0536(17) Uani 1 1 d . . .
H81 H 0.6327 0.1192 -0.0218 0.064 Uiso 1 1 calc R . .
C82 C 0.6118(2) 0.1431(2) -0.1291(4) 0.0573(18) Uani 1 1 d . . .
H82 H 0.6269 0.1246 -0.1498 0.069 Uiso 1 1 calc R . .
C83 C 0.5859(2) 0.1732(2) -0.1753(4) 0.0559(18) Uani 1 1 d . . .
H83 H 0.5833 0.1751 -0.2278 0.067 Uiso 1 1 calc R . .
C84 C 0.5641(2) 0.2003(2) -0.1460(4) 0.0455(15) Uani 1 1 d . . .
H84 H 0.5461 0.2205 -0.1781 0.055 Uiso 1 1 calc R . .
C85 C 0.48193(15) 0.48565(17) 0.1432(3) 0.0300(11) Uani 1 1 d . . .
C86 C 0.50481(17) 0.52263(18) 0.1467(3) 0.0347(12) Uani 1 1 d . . .
H86 H 0.5310 0.5197 0.1469 0.042 Uiso 1 1 calc R . .
C87 C 0.4893(2) 0.56364(19) 0.1497(4) 0.0480(15) Uani 1 1 d . . .
H87 H 0.5050 0.5887 0.1507 0.058 Uiso 1 1 calc R . .
C88 C 0.4519(2) 0.5691(2) 0.1513(4) 0.0470(15) Uani 1 1 d . . .
H88 H 0.4418 0.5976 0.1537 0.056 Uiso 1 1 calc R . .
C89 C 0.42902(19) 0.5324(2) 0.1494(4) 0.0441(14) Uani 1 1 d . . .
H89 H 0.4031 0.5357 0.1508 0.053 Uiso 1 1 calc R . .
C90 C 0.44390(17) 0.49109(19) 0.1454(3) 0.0374(12) Uani 1 1 d . . .
H90 H 0.4280 0.4661 0.1441 0.045 Uiso 1 1 calc R . .
C91 C 0.54830(16) 0.43856(16) 0.1317(3) 0.0294(11) Uani 1 1 d . . .
C92 C 0.55491(17) 0.44510(18) 0.0634(3) 0.0368(12) Uani 1 1 d . . .
H92 H 0.5337 0.4434 0.0168 0.044 Uiso 1 1 calc R . .
C93 C 0.59232(18) 0.45413(19) 0.0625(4) 0.0414(14) Uani 1 1 d . . .
H93 H 0.5967 0.4585 0.0153 0.050 Uiso 1 1 calc R . .
C94 C 0.62356(18) 0.4569(2) 0.1302(4) 0.0428(14) Uani 1 1 d . . .
H94 H 0.6491 0.4640 0.1295 0.051 Uiso 1 1 calc R . .
C95 C 0.61721(18) 0.4492(2) 0.1984(4) 0.0458(15) Uani 1 1 d . . .
H95 H 0.6386 0.4504 0.2448 0.055 Uiso 1 1 calc R . .
C96 C 0.58021(18) 0.43994(19) 0.1997(3) 0.0399(13) Uani 1 1 d . . .
H96 H 0.5762 0.4344 0.2470 0.048 Uiso 1 1 calc R . .
C97 C 0.46988(15) 0.41116(16) 0.0449(3) 0.0270(10) Uani 1 1 d . . .
C98 C 0.44816(16) 0.43898(18) -0.0130(3) 0.0351(12) Uani 1 1 d . . .
H98 H 0.4488 0.4696 -0.0045 0.042 Uiso 1 1 calc R . .
C99 C 0.42577(17) 0.4222(2) -0.0827(3) 0.0383(13) Uani 1 1 d . . .
H99 H 0.4103 0.4413 -0.1212 0.046 Uiso 1 1 calc R . .
C100 C 0.42555(18) 0.3775(2) -0.0972(3) 0.0410(13) Uani 1 1 d . . .
H100 H 0.4107 0.3662 -0.1458 0.049 Uiso 1 1 calc R . .
C101 C 0.44712(19) 0.3500(2) -0.0402(3) 0.0417(13) Uani 1 1 d . . .
H101 H 0.4470 0.3195 -0.0497 0.050 Uiso 1 1 calc R . .
C102 C 0.46889(18) 0.36612(18) 0.0304(3) 0.0376(13) Uani 1 1 d . . .
H102 H 0.4833 0.3466 0.0693 0.045 Uiso 1 1 calc R . .
O1 O 0.6146(2) 0.3782(3) -0.2012(5) 0.117(3) Uani 1 1 d . . .
O2 O 0.6788(2) 0.3944(3) -0.1237(4) 0.115(3) Uani 1 1 d . . .
O3 O 0.6666(3) 0.3812(4) -0.2527(5) 0.135(4) Uani 1 1 d . . .
O4 O 0.6599(3) 0.3266(4) -0.1781(9) 0.180(5) Uani 1 1 d . . .
C104 C 0.3363(4) 0.0113(4) -0.3836(7) 0.109(4) Uiso 1 1 d . . .
H10C H 0.3504 -0.0090 -0.4061 0.163 Uiso 1 1 calc R . .
H10D H 0.3551 0.0304 -0.3470 0.163 Uiso 1 1 calc R . .
H10E H 0.3213 -0.0052 -0.3574 0.163 Uiso 1 1 calc R . .
C105 C 0.3114(4) 0.0360(4) -0.4394(7) 0.101(3) Uiso 1 1 d . . .
H10F H 0.2925 0.0168 -0.4767 0.121 Uiso 1 1 calc R . .
H10G H 0.3264 0.0526 -0.4664 0.121 Uiso 1 1 calc R . .
O5 O 0.2909(3) 0.0656(3) -0.4067(5) 0.113(3) Uiso 1 1 d . . .
C106 C 0.2638(4) 0.0939(4) -0.4617(7) 0.107(4) Uiso 1 1 d . . .
H10H H 0.2467 0.0761 -0.5042 0.128 Uiso 1 1 calc R . .
H10I H 0.2787 0.1145 -0.4830 0.128 Uiso 1 1 calc R . .
C107 C 0.2393(6) 0.1188(6) -0.4256(11) 0.175(7) Uiso 1 1 d . . .
H10J H 0.2212 0.1378 -0.4637 0.262 Uiso 1 1 calc R . .
H10K H 0.2243 0.0984 -0.4053 0.262 Uiso 1 1 calc R . .
H10L H 0.2562 0.1368 -0.3841 0.262 Uiso 1 1 calc R . .
C103 C 0.7259(4) 0.5344(4) 0.2986(6) 0.099(3) Uani 1 1 d . . .
H10M H 0.7241 0.5433 0.3486 0.119 Uiso 1 1 calc R . .
H10N H 0.7036 0.5480 0.2584 0.119 Uiso 1 1 calc R . .
Cl2 Cl 0.76882(10) 0.55355(13) 0.2906(3) 0.1557(19) Uani 1 1 d . . .
Cl3 Cl 0.72207(10) 0.48066(12) 0.2907(4) 0.185(3) Uani 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
Ag1 Ag1 Ag2 60.688(8) 2_655 .
Ag1 Ag1 Ag3 60.838(13) 2_655 2_655
Ag1 Ag1 Ag3 61.633(14) 2_655 .
Ag2 Ag1 Ag3 61.567(10) . 2_655
Ag2 Ag1 Ag3 61.838(10) . .
Ag3 Ag1 Ag3 112.786(15) . 2_655
C1 Ag1 Ag1 71.34(14) . 2_655
C1 Ag1 Ag2 109.63(13) . .
C1 Ag1 Ag3 50.74(13) . .
C1 Ag1 Ag3 128.98(14) . 2_655
C1 Ag1 C11 179.3(2) . .
C11 Ag1 Ag1 109.36(14) . 2_655
C11 Ag1 Ag2 70.95(13) . .
C11 Ag1 Ag3 129.65(13) . .
C11 Ag1 Ag3 51.63(14) . 2_655
Ag1 Ag2 Ag1 58.626(17) . 2_655
Ag1 Ag2 Ag3 59.723(12) 2_655 2_655
Ag1 Ag2 Ag3 59.722(12) . .
Ag1 Ag2 Ag3 60.226(13) . 2_655
Ag1 Ag2 Ag3 60.227(12) 2_655 .
Ag3 Ag2 Ag3 109.96(2) 2_655 .
C21 Ag2 Ag1 69.26(14) . .
C21 Ag2 Ag1 69.26(14) 2_655 2_655
C21 Ag2 Ag1 108.41(14) 2_655 .
C21 Ag2 Ag1 108.41(14) . 2_655
C21 Ag2 Ag3 52.06(14) . .
C21 Ag2 Ag3 126.13(14) . 2_655
C21 Ag2 Ag3 126.13(15) 2_655 .
C21 Ag2 Ag3 52.06(14) 2_655 2_655
C21 Ag2 C21 177.5(3) . 2_655
Ag1 Ag3 Ag1 57.530(14) . 2_655
Ag1 Ag3 Ag2 58.441(12) . .
Ag1 Ag3 Ag2 58.206(12) 2_655 .
P1 Ag3 Ag1 147.31(3) . 2_655
P1 Ag3 Ag1 146.65(3) . .
P1 Ag3 Ag2 143.75(3) . .
P1 Ag3 C11 115.92(12) . 2_655
P1 Ag3 C21 115.17(13) . .
C1 Ag3 Ag1 65.09(12) . 2_655
C1 Ag3 Ag1 40.93(12) . .
C1 Ag3 Ag2 97.10(12) . .
C1 Ag3 P1 116.66(12) . .
C1 Ag3 C11 102.62(16) . 2_655
C1 Ag3 C21 102.07(16) . .
C11 Ag3 Ag1 40.56(11) 2_655 2_655
C11 Ag3 Ag1 95.75(11) 2_655 .
C11 Ag3 Ag2 64.85(11) 2_655 .
C11 Ag3 C21 102.26(17) 2_655 .
C21 Ag3 Ag1 64.01(12) . .
C21 Ag3 Ag1 94.98(13) . 2_655
C21 Ag3 Ag2 39.67(13) . .
P2 Ag4 C11 121.76(11) . .
P2 Ag4 C21 101.40(11) . .
P3 Ag4 P2 115.24(4) . .
P3 Ag4 C11 103.53(11) . .
P3 Ag4 C21 127.70(13) . .
C11 Ag4 C21 85.45(16) . .
P4 Ag5 P4 111.06(6) 2_655 .
P4 Ag5 C1 104.13(11) 2_655 2_655
P4 Ag5 C1 124.90(11) 2_655 .
P4 Ag5 C1 124.90(11) . 2_655
P4 Ag5 C1 104.12(11) . .
C1 Ag5 C1 87.7(2) 2_655 .
C31 P1 Ag3 115.57(16) . .
C31 P1 C37 103.1(2) . .
C31 P1 C43 103.5(2) . .
C37 P1 Ag3 115.04(16) . .
C37 P1 C43 103.5(2) . .
C43 P1 Ag3 114.59(16) . .
C49 P2 Ag4 117.23(16) . .
C49 P2 C55 103.7(2) . .
C49 P2 C61 103.6(2) . .
C55 P2 Ag4 110.12(17) . .
C55 P2 C61 102.4(2) . .
C61 P2 Ag4 117.89(17) . .
C67 P3 Ag4 110.31(19) . .
C67 P3 C79 105.4(3) . .
C73 P3 Ag4 121.78(18) . .
C73 P3 C67 104.6(2) . .
C73 P3 C79 101.7(2) . .
C79 P3 Ag4 111.62(18) . .
C85 P4 Ag5 113.46(17) . .
C85 P4 C91 103.2(2) . .
C91 P4 Ag5 113.16(17) . .
C97 P4 Ag5 117.19(17) . .
C97 P4 C85 103.8(2) . .
C97 P4 C91 104.7(2) . .
O1 Cl1 O2 117.1(5) . .
O1 Cl1 O4 95.3(6) . .
O2 Cl1 O4 100.3(7) . .
O3 Cl1 O1 121.5(6) . .
O3 Cl1 O2 116.3(5) . .
O3 Cl1 O4 97.0(7) . .
Ag1 C1 Ag3 88.33(17) . .
Ag1 C1 Ag5 92.96(18) . .
Ag3 C1 Ag5 138.7(2) . .
C2 C1 Ag1 175.6(4) . .
C2 C1 Ag3 91.0(3) . .
C2 C1 Ag5 84.7(3) . .
C1 C2 C3 178.8(6) . .
C4 C3 C2 176.9(6) . .
C3 C4 C5 174.2(7) . .
C4 C5 H5 108.6 . .
C4 C5 C6 112.4(6) . .
C4 C5 C10 108.8(6) . .
C6 C5 H5 108.6 . .
C6 C5 C10 109.9(6) . .
C10 C5 H5 108.6 . .
C5 C6 H6A 109.7 . .
C5 C6 H6B 109.7 . .
C5 C6 C7 110.0(6) . .
H6A C6 H6B 108.2 . .
C7 C6 H6A 109.7 . .
C7 C6 H6B 109.7 . .
C6 C7 H7A 109.1 . .
C6 C7 H7B 109.1 . .
H7A C7 H7B 107.9 . .
C8 C7 C6 112.3(6) . .
C8 C7 H7A 109.1 . .
C8 C7 H7B 109.1 . .
C7 C8 H8A 109.1 . .
C7 C8 H8B 109.1 . .
H8A C8 H8B 107.8 . .
C9 C8 C7 112.7(7) . .
C9 C8 H8A 109.1 . .
C9 C8 H8B 109.1 . .
C8 C9 H9A 109.6 . .
C8 C9 H9B 109.6 . .
C8 C9 C10 110.5(7) . .
H9A C9 H9B 108.1 . .
C10 C9 H9A 109.6 . .
C10 C9 H9B 109.6 . .
C5 C10 H10A 109.8 . .
C5 C10 H10B 109.8 . .
C9 C10 C5 109.4(6) . .
C9 C10 H10A 109.8 . .
C9 C10 H10B 109.8 . .
H10A C10 H10B 108.2 . .
Ag1 C11 Ag3 87.82(17) . 2_655
Ag1 C11 Ag4 92.99(18) . .
Ag3 C11 Ag4 142.6(2) 2_655 .
C12 C11 Ag1 175.4(4) . .
C12 C11 Ag3 89.6(4) . 2_655
C12 C11 Ag4 86.8(3) . .
C11 C12 C13 179.1(6) . .
C14 C13 C12 178.1(6) . .
C13 C14 C15 177.9(6) . .
C14 C15 H15 107.2 . .
C14 C15 C16 111.7(5) . .
C14 C15 C20 111.6(5) . .
C16 C15 H15 107.2 . .
C20 C15 H15 107.2 . .
C20 C15 C16 111.4(5) . .
C15 C16 H16A 109.7 . .
C15 C16 H16B 109.7 . .
C15 C16 C17 109.9(6) . .
H16A C16 H16B 108.2 . .
C17 C16 H16A 109.7 . .
C17 C16 H16B 109.7 . .
C16 C17 H17A 109.3 . .
C16 C17 H17B 109.3 . .
H17A C17 H17B 108.0 . .
C18 C17 C16 111.5(6) . .
C18 C17 H17A 109.3 . .
C18 C17 H17B 109.3 . .
C17 C18 H18A 109.1 . .
C17 C18 H18B 109.1 . .
C17 C18 C19 112.5(6) . .
H18A C18 H18B 107.8 . .
C19 C18 H18A 109.1 . .
C19 C18 H18B 109.1 . .
C18 C19 H19A 109.3 . .
C18 C19 H19B 109.3 . .
C18 C19 C20 111.4(7) . .
H19A C19 H19B 108.0 . .
C20 C19 H19A 109.3 . .
C20 C19 H19B 109.3 . .
C15 C20 C19 110.3(6) . .
C15 C20 H20A 109.6 . .
C15 C20 H20B 109.6 . .
C19 C20 H20A 109.6 . .
C19 C20 H20B 109.6 . .
H20A C20 H20B 108.1 . .
Ag2 C21 Ag3 88.26(19) . .
Ag2 C21 Ag4 97.6(2) . .
Ag3 C21 Ag4 135.5(2) . .
C22 C21 Ag2 174.9(4) . .
C22 C21 Ag3 88.9(3) . .
C22 C21 Ag4 81.4(4) . .
C21 C22 C23 176.9(6) . .
C24 C23 C22 178.4(7) . .
C23 C24 C25 177.7(8) . .
C24 C25 H25 106.6 . .
C24 C25 C26 110.8(7) . .
C24 C25 C30 113.0(7) . .
C26 C25 H25 106.6 . .
C30 C25 H25 106.6 . .
C30 C25 C26 112.6(7) . .
C25 C26 H26A 109.4 . .
C25 C26 H26B 109.4 . .
C25 C26 C27 111.3(8) . .
H26A C26 H26B 108.0 . .
C27 C26 H26A 109.4 . .
C27 C26 H26B 109.4 . .
C26 C27 H27A 109.2 . .
C26 C27 H27B 109.2 . .
H27A C27 H27B 107.9 . .
C28 C27 C26 112.2(10) . .
C28 C27 H27A 109.2 . .
C28 C27 H27B 109.2 . .
C27 C28 H28A 108.8 . .
C27 C28 H28B 108.8 . .
C27 C28 C29 114.0(10) . .
H28A C28 H28B 107.7 . .
C29 C28 H28A 108.8 . .
C29 C28 H28B 108.8 . .
C28 C29 H29A 109.5 . .
C28 C29 H29B 109.5 . .
H29A C29 H29B 108.1 . .
C30 C29 C28 110.7(9) . .
C30 C29 H29A 109.5 . .
C30 C29 H29B 109.5 . .
C25 C30 C29 113.5(9) . .
C25 C30 H30A 108.9 . .
C25 C30 H30B 108.9 . .
C29 C30 H30A 108.9 . .
C29 C30 H30B 108.9 . .
H30A C30 H30B 107.7 . .
C32 C31 P1 123.2(4) . .
C32 C31 C36 118.2(5) . .
C36 C31 P1 118.6(4) . .
C31 C32 H32 119.8 . .
C33 C32 C31 120.5(5) . .
C33 C32 H32 119.8 . .
C32 C33 H33 119.6 . .
C34 C33 C32 120.9(6) . .
C34 C33 H33 119.6 . .
C33 C34 H34 120.2 . .
C33 C34 C35 119.5(6) . .
C35 C34 H34 120.2 . .
C34 C35 H35 119.7 . .
C36 C35 C34 120.7(6) . .
C36 C35 H35 119.7 . .
C31 C36 H36 119.9 . .
C35 C36 C31 120.2(5) . .
C35 C36 H36 119.9 . .
C38 C37 P1 123.1(4) . .
C38 C37 C42 118.8(5) . .
C42 C37 P1 118.1(4) . .
C37 C38 H38 119.7 . .
C39 C38 C37 120.6(5) . .
C39 C38 H38 119.7 . .
C38 C39 H39 119.6 . .
C40 C39 C38 120.9(6) . .
C40 C39 H39 119.6 . .
C39 C40 H40 120.2 . .
C39 C40 C41 119.7(6) . .
C41 C40 H40 120.2 . .
C40 C41 H41 119.7 . .
C40 C41 C42 120.5(6) . .
C42 C41 H41 119.7 . .
C37 C42 H42 120.3 . .
C41 C42 C37 119.5(5) . .
C41 C42 H42 120.3 . .
C44 C43 P1 117.4(4) . .
C48 C43 P1 123.6(4) . .
C48 C43 C44 119.0(5) . .
C43 C44 H44 120.2 . .
C45 C44 C43 119.5(5) . .
C45 C44 H44 120.2 . .
C44 C45 H45 119.6 . .
C44 C45 C46 120.8(6) . .
C46 C45 H45 119.6 . .
C45 C46 H46 120.0 . .
C47 C46 C45 120.0(5) . .
C47 C46 H46 120.0 . .
C46 C47 H47 120.3 . .
C46 C47 C48 119.5(6) . .
C48 C47 H47 120.3 . .
C43 C48 C47 121.3(5) . .
C43 C48 H48 119.4 . .
C47 C48 H48 119.4 . .
C50 C49 P2 118.5(4) . .
C50 C49 C54 118.6(5) . .
C54 C49 P2 122.8(4) . .
C49 C50 H50 119.6 . .
C49 C50 C51 120.8(5) . .
C51 C50 H50 119.6 . .
C50 C51 H51 120.1 . .
C52 C51 C50 119.7(5) . .
C52 C51 H51 120.1 . .
C51 C52 H52 119.9 . .
C51 C52 C53 120.1(6) . .
C53 C52 H52 119.9 . .
C52 C53 H53 119.9 . .
C52 C53 C54 120.2(5) . .
C54 C53 H53 119.9 . .
C49 C54 H54 119.7 . .
C53 C54 C49 120.5(5) . .
C53 C54 H54 119.7 . .
C56 C55 P2 117.9(4) . .
C56 C55 C60 118.7(5) . .
C60 C55 P2 123.3(4) . .
C55 C56 H56 119.7 . .
C55 C56 C57 120.7(5) . .
C57 C56 H56 119.7 . .
C56 C57 H57 120.0 . .
C58 C57 C56 120.1(6) . .
C58 C57 H57 120.0 . .
C57 C58 H58 119.9 . .
C57 C58 C59 120.2(6) . .
C59 C58 H58 119.9 . .
C58 C59 H59 120.1 . .
C58 C59 C60 119.8(6) . .
C60 C59 H59 120.1 . .
C55 C60 C59 120.5(6) . .
C55 C60 H60 119.7 . .
C59 C60 H60 119.7 . .
C62 C61 P2 123.6(4) . .
C62 C61 C66 119.0(5) . .
C66 C61 P2 117.3(4) . .
C61 C62 H62 119.9 . .
C61 C62 C63 120.2(5) . .
C63 C62 H62 119.9 . .
C62 C63 H63 119.7 . .
C64 C63 C62 120.6(6) . .
C64 C63 H63 119.7 . .
C63 C64 H64 120.2 . .
C63 C64 C65 119.5(5) . .
C65 C64 H64 120.2 . .
C64 C65 H65 119.6 . .
C64 C65 C66 120.8(6) . .
C66 C65 H65 119.6 . .
C61 C66 H66 120.1 . .
C65 C66 C61 119.9(6) . .
C65 C66 H66 120.1 . .
C68 C67 P3 124.2(5) . .
C72 C67 P3 117.4(4) . .
C72 C67 C68 118.4(5) . .
C67 C68 H68 119.9 . .
C69 C68 C67 120.2(6) . .
C69 C68 H68 119.9 . .
C68 C69 H69 119.7 . .
C70 C69 C68 120.6(6) . .
C70 C69 H69 119.7 . .
C69 C70 H70 119.9 . .
C71 C70 C69 120.2(6) . .
C71 C70 H70 119.9 . .
C70 C71 H71 120.3 . .
C70 C71 C72 119.5(6) . .
C72 C71 H71 120.3 . .
C67 C72 C71 121.2(6) . .
C67 C72 H72 119.4 . .
C71 C72 H72 119.4 . .
C74 C73 P3 123.1(4) . .
C78 C73 P3 117.6(4) . .
C78 C73 C74 119.3(5) . .
C73 C74 H74 119.5 . .
C73 C74 C75 121.0(6) . .
C75 C74 H74 119.5 . .
C74 C75 H75 120.4 . .
C76 C75 C74 119.2(6) . .
C76 C75 H75 120.4 . .
C75 C76 H76 119.5 . .
C75 C76 C77 121.0(6) . .
C77 C76 H76 119.5 . .
C76 C77 H77 120.4 . .
C76 C77 C78 119.1(6) . .
C78 C77 H77 120.4 . .
C73 C78 C77 120.4(6) . .
C73 C78 H78 119.8 . .
C77 C78 H78 119.8 . .
C80 C79 P3 117.2(4) . .
C80 C79 C84 119.4(5) . .
C84 C79 P3 123.4(5) . .
C79 C80 H80 119.6 . .
C79 C80 C81 120.7(6) . .
C81 C80 H80 119.6 . .
C80 C81 H81 120.0 . .
C82 C81 C80 119.9(6) . .
C82 C81 H81 120.0 . .
C81 C82 H82 120.1 . .
C81 C82 C83 119.7(6) . .
C83 C82 H82 120.1 . .
C82 C83 H83 119.6 . .
C84 C83 C82 120.7(6) . .
C84 C83 H83 119.6 . .
C79 C84 H84 120.3 . .
C83 C84 C79 119.5(6) . .
C83 C84 H84 120.3 . .
C86 C85 P4 123.4(4) . .
C86 C85 C90 118.5(5) . .
C90 C85 P4 118.1(4) . .
C85 C86 H86 120.1 . .
C87 C86 C85 119.9(6) . .
C87 C86 H86 120.1 . .
C86 C87 H87 119.1 . .
C88 C87 C86 121.7(6) . .
C88 C87 H87 119.1 . .
C87 C88 H88 120.6 . .
C87 C88 C89 118.9(6) . .
C89 C88 H88 120.6 . .
C88 C89 H89 119.9 . .
C90 C89 C88 120.1(6) . .
C90 C89 H89 119.9 . .
C85 C90 H90 119.6 . .
C89 C90 C85 120.8(6) . .
C89 C90 H90 119.6 . .
C92 C91 P4 123.3(4) . .
C92 C91 C96 119.0(5) . .
C96 C91 P4 117.7(4) . .
C91 C92 H92 119.9 . .
C91 C92 C93 120.2(6) . .
C93 C92 H92 119.9 . .
C92 C93 H93 119.7 . .
C92 C93 C94 120.5(6) . .
C94 C93 H93 119.7 . .
C93 C94 H94 120.3 . .
C95 C94 C93 119.3(6) . .
C95 C94 H94 120.3 . .
C94 C95 H95 119.7 . .
C96 C95 C94 120.5(6) . .
C96 C95 H95 119.7 . .
C91 C96 H96 119.8 . .
C95 C96 C91 120.3(6) . .
C95 C96 H96 119.8 . .
C98 C97 P4 123.5(4) . .
C98 C97 C102 118.6(5) . .
C102 C97 P4 117.9(4) . .
C97 C98 H98 119.8 . .
C99 C98 C97 120.3(5) . .
C99 C98 H98 119.8 . .
C98 C99 H99 119.6 . .
C98 C99 C100 120.8(5) . .
C100 C99 H99 119.6 . .
C99 C100 H100 120.5 . .
C101 C100 C99 119.0(5) . .
C101 C100 H100 120.5 . .
C100 C101 H101 119.5 . .
C100 C101 C102 121.0(6) . .
C102 C101 H101 119.5 . .
C97 C102 H102 119.9 . .
C101 C102 C97 120.3(5) . .
C101 C102 H102 119.9 . .
H10C C104 H10D 109.5 . .
H10C C104 H10E 109.5 . .
H10D C104 H10E 109.5 . .
C105 C104 H10C 109.5 . .
C105 C104 H10D 109.5 . .
C105 C104 H10E 109.5 . .
C104 C105 H10F 109.8 . .
C104 C105 H10G 109.8 . .
C104 C105 O5 109.6(11) . .
H10F C105 H10G 108.2 . .
O5 C105 H10F 109.8 . .
O5 C105 H10G 109.8 . .
C105 O5 C106 113.9(9) . .
O5 C106 H10H 109.5 . .
O5 C106 H10I 109.5 . .
O5 C106 C107 110.7(12) . .
H10H C106 H10I 108.1 . .
C107 C106 H10H 109.5 . .
C107 C106 H10I 109.5 . .
C106 C107 H10J 109.5 . .
C106 C107 H10K 109.5 . .
C106 C107 H10L 109.5 . .
H10J C107 H10K 109.5 . .
H10J C107 H10L 109.5 . .
H10K C107 H10L 109.5 . .
H10M C103 H10N 107.8 . .
Cl2 C103 H10M 109.1 . .
Cl2 C103 H10N 109.1 . .
Cl3 C103 H10M 109.1 . .
Cl3 C103 H10N 109.1 . .
Cl3 C103 Cl2 112.6(7) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 Ag1 3.0802(8) 2_655
Ag1 Ag2 3.1457(6) .
Ag1 Ag3 3.2125(6) 2_655
Ag1 Ag3 3.1881(5) .
Ag1 C1 2.090(5) .
Ag1 C11 2.090(5) .
Ag2 Ag1 3.1457(6) 2_655
Ag2 Ag3 3.2546(5) .
Ag2 Ag3 3.2546(5) 2_655
Ag2 C21 2.079(6) .
Ag2 C21 2.079(6) 2_655
Ag3 Ag1 3.2125(6) 2_655
Ag3 P1 2.4964(13) .
Ag3 C1 2.470(5) .
Ag3 C11 2.520(5) 2_655
Ag3 C21 2.568(5) .
Ag4 P2 2.5399(13) .
Ag4 P3 2.5113(14) .
Ag4 C11 2.587(5) .
Ag4 C21 2.645(5) .
Ag5 P4 2.4987(13) 2_655
Ag5 P4 2.4987(13) .
Ag5 C1 2.616(5) .
Ag5 C1 2.616(5) 2_655
P1 C31 1.822(5) .
P1 C37 1.830(5) .
P1 C43 1.832(5) .
P2 C49 1.821(5) .
P2 C55 1.831(5) .
P2 C61 1.837(5) .
P3 C67 1.832(6) .
P3 C73 1.830(6) .
P3 C79 1.835(6) .
P4 C85 1.825(5) .
P4 C91 1.831(5) .
P4 C97 1.813(5) .
Cl1 O1 1.365(7) .
Cl1 O2 1.383(7) .
Cl1 O3 1.355(8) .
Cl1 O4 1.618(12) .
C1 C2 1.224(7) .
C2 C3 1.378(7) .
C3 C4 1.211(8) .
C4 C5 1.483(9) .
C5 H5 1.0000 .
C5 C6 1.504(10) .
C5 C10 1.558(9) .
C6 H6A 0.9900 .
C6 H6B 0.9900 .
C6 C7 1.523(9) .
C7 H7A 0.9900 .
C7 H7B 0.9900 .
C7 C8 1.513(11) .
C8 H8A 0.9900 .
C8 H8B 0.9900 .
C8 C9 1.478(12) .
C9 H9A 0.9900 .
C9 H9B 0.9900 .
C9 C10 1.541(10) .
C10 H10A 0.9900 .
C10 H10B 0.9900 .
C11 Ag3 2.520(5) 2_655
C11 C12 1.218(7) .
C12 C13 1.390(7) .
C13 C14 1.193(8) .
C14 C15 1.479(8) .
C15 H15 1.0000 .
C15 C16 1.532(9) .
C15 C20 1.512(9) .
C16 H16A 0.9900 .
C16 H16B 0.9900 .
C16 C17 1.533(9) .
C17 H17A 0.9900 .
C17 H17B 0.9900 .
C17 C18 1.489(12) .
C18 H18A 0.9900 .
C18 H18B 0.9900 .
C18 C19 1.506(12) .
C19 H19A 0.9900 .
C19 H19B 0.9900 .
C19 C20 1.546(9) .
C20 H20A 0.9900 .
C20 H20B 0.9900 .
C21 C22 1.234(8) .
C22 C23 1.382(8) .
C23 C24 1.186(9) .
C24 C25 1.477(10) .
C25 H25 1.0000 .
C25 C26 1.499(11) .
C25 C30 1.480(12) .
C26 H26A 0.9900 .
C26 H26B 0.9900 .
C26 C27 1.525(12) .
C27 H27A 0.9900 .
C27 H27B 0.9900 .
C27 C28 1.456(16) .
C28 H28A 0.9900 .
C28 H28B 0.9900 .
C28 C29 1.528(16) .
C29 H29A 0.9900 .
C29 H29B 0.9900 .
C29 C30 1.511(13) .
C30 H30A 0.9900 .
C30 H30B 0.9900 .
C31 C32 1.391(7) .
C31 C36 1.404(7) .
C32 H32 0.9500 .
C32 C33 1.387(8) .
C33 H33 0.9500 .
C33 C34 1.363(9) .
C34 H34 0.9500 .
C34 C35 1.381(9) .
C35 H35 0.9500 .
C35 C36 1.380(8) .
C36 H36 0.9500 .
C37 C38 1.386(7) .
C37 C42 1.400(8) .
C38 H38 0.9500 .
C38 C39 1.370(8) .
C39 H39 0.9500 .
C39 C40 1.365(9) .
C40 H40 0.9500 .
C40 C41 1.379(10) .
C41 H41 0.9500 .
C41 C42 1.388(8) .
C42 H42 0.9500 .
C43 C44 1.401(7) .
C43 C48 1.372(7) .
C44 H44 0.9500 .
C44 C45 1.376(8) .
C45 H45 0.9500 .
C45 C46 1.382(9) .
C46 H46 0.9500 .
C46 C47 1.371(9) .
C47 H47 0.9500 .
C47 C48 1.387(8) .
C48 H48 0.9500 .
C49 C50 1.382(7) .
C49 C54 1.400(7) .
C50 H50 0.9500 .
C50 C51 1.397(8) .
C51 H51 0.9500 .
C51 C52 1.379(9) .
C52 H52 0.9500 .
C52 C53 1.380(9) .
C53 H53 0.9500 .
C53 C54 1.382(8) .
C54 H54 0.9500 .
C55 C56 1.387(8) .
C55 C60 1.395(7) .
C56 H56 0.9500 .
C56 C57 1.391(8) .
C57 H57 0.9500 .
C57 C58 1.378(10) .
C58 H58 0.9500 .
C58 C59 1.381(10) .
C59 H59 0.9500 .
C59 C60 1.395(8) .
C60 H60 0.9500 .
C61 C62 1.383(7) .
C61 C66 1.397(8) .
C62 H62 0.9500 .
C62 C63 1.402(8) .
C63 H63 0.9500 .
C63 C64 1.364(9) .
C64 H64 0.9500 .
C64 C65 1.384(10) .
C65 H65 0.9500 .
C65 C66 1.389(9) .
C66 H66 0.9500 .
C67 C68 1.396(8) .
C67 C72 1.394(8) .
C68 H68 0.9500 .
C68 C69 1.390(9) .
C69 H69 0.9500 .
C69 C70 1.380(10) .
C70 H70 0.9500 .
C70 C71 1.378(10) .
C71 H71 0.9500 .
C71 C72 1.395(9) .
C72 H72 0.9500 .
C73 C74 1.383(8) .
C73 C78 1.375(8) .
C74 H74 0.9500 .
C74 C75 1.389(9) .
C75 H75 0.9500 .
C75 C76 1.367(10) .
C76 H76 0.9500 .
C76 C77 1.384(10) .
C77 H77 0.9500 .
C77 C78 1.399(8) .
C78 H78 0.9500 .
C79 C80 1.377(8) .
C79 C84 1.401(8) .
C80 H80 0.9500 .
C80 C81 1.386(9) .
C81 H81 0.9500 .
C81 C82 1.371(10) .
C82 H82 0.9500 .
C82 C83 1.390(10) .
C83 H83 0.9500 .
C83 C84 1.375(9) .
C84 H84 0.9500 .
C85 C86 1.389(8) .
C85 C90 1.396(8) .
C86 H86 0.9500 .
C86 C87 1.382(8) .
C87 H87 0.9500 .
C87 C88 1.373(10) .
C88 H88 0.9500 .
C88 C89 1.386(10) .
C89 H89 0.9500 .
C89 C90 1.385(8) .
C90 H90 0.9500 .
C91 C92 1.380(8) .
C91 C96 1.404(8) .
C92 H92 0.9500 .
C92 C93 1.384(8) .
C93 H93 0.9500 .
C93 C94 1.389(9) .
C94 H94 0.9500 .
C94 C95 1.380(9) .
C95 H95 0.9500 .
C95 C96 1.374(9) .
C96 H96 0.9500 .
C97 C98 1.393(7) .
C97 C102 1.402(8) .
C98 H98 0.9500 .
C98 C99 1.381(8) .
C99 H99 0.9500 .
C99 C100 1.391(9) .
C100 H100 0.9500 .
C100 C101 1.376(9) .
C101 H101 0.9500 .
C101 C102 1.380(8) .
C102 H102 0.9500 .
C104 H10C 0.9800 .
C104 H10D 0.9800 .
C104 H10E 0.9800 .
C104 C105 1.354(15) .
C105 H10F 0.9900 .
C105 H10G 0.9900 .
C105 O5 1.426(13) .
O5 C106 1.445(14) .
C106 H10H 0.9900 .
C106 H10I 0.9900 .
C106 C107 1.48(2) .
C107 H10J 0.9800 .
C107 H10K 0.9800 .
C107 H10L 0.9800 .
C103 H10M 0.9900 .
C103 H10N 0.9900 .
C103 Cl2 1.709(13) .
C103 Cl3 1.653(12) .
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
Ag3 P1 C31 C32 141.1(4)
Ag3 P1 C31 C36 -38.6(4)
Ag3 P1 C37 C38 141.2(4)
Ag3 P1 C37 C42 -37.7(5)
Ag3 P1 C43 C44 -36.7(5)
Ag3 P1 C43 C48 141.9(4)
Ag4 P2 C49 C50 27.0(5)
Ag4 P2 C49 C54 -155.0(4)
Ag4 P2 C55 C56 47.4(5)
Ag4 P2 C55 C60 -129.4(4)
Ag4 P2 C61 C62 -147.0(4)
Ag4 P2 C61 C66 37.2(5)
Ag4 P3 C67 C68 150.9(5)
Ag4 P3 C67 C72 -26.0(5)
Ag4 P3 C73 C74 156.7(4)
Ag4 P3 C73 C78 -25.0(5)
Ag4 P3 C79 C80 -40.9(5)
Ag4 P3 C79 C84 140.6(5)
Ag5 P4 C85 C86 118.1(4)
Ag5 P4 C85 C90 -60.2(5)
Ag5 P4 C91 C92 150.6(4)
Ag5 P4 C91 C96 -31.7(5)
Ag5 P4 C97 C98 141.6(4)
Ag5 P4 C97 C102 -38.2(5)
P1 C31 C32 C33 -179.5(4)
P1 C31 C36 C35 -178.5(5)
P1 C37 C38 C39 -179.7(4)
P1 C37 C42 C41 -179.6(5)
P1 C43 C44 C45 179.9(5)
P1 C43 C48 C47 -178.6(5)
P2 C49 C50 C51 178.6(4)
P2 C49 C54 C53 -178.1(4)
P2 C55 C56 C57 -177.6(5)
P2 C55 C60 C59 177.0(5)
P2 C61 C62 C63 -177.0(4)
P2 C61 C66 C65 176.8(5)
P3 C67 C68 C69 -178.6(5)
P3 C67 C72 C71 177.7(4)
P3 C73 C74 C75 178.4(5)
P3 C73 C78 C77 -178.0(5)
P3 C79 C80 C81 -177.1(5)
P3 C79 C84 C83 176.5(5)
P4 C85 C86 C87 179.8(5)
P4 C85 C90 C89 179.5(5)
P4 C91 C92 C93 175.8(4)
P4 C91 C96 C95 -175.5(5)
P4 C97 C98 C99 -178.9(4)
P4 C97 C102 C101 -179.5(5)
C4 C5 C6 C7 179.0(6)
C4 C5 C10 C9 177.3(7)
C5 C6 C7 C8 -55.1(9)
C6 C5 C10 C9 -59.3(8)
C6 C7 C8 C9 54.3(10)
C7 C8 C9 C10 -55.1(11)
C8 C9 C10 C5 57.3(10)
C10 C5 C6 C7 57.8(8)
C14 C15 C16 C17 177.4(5)
C14 C15 C20 C19 -178.1(6)
C15 C16 C17 C18 56.0(8)
C16 C15 C20 C19 56.2(7)
C16 C17 C18 C19 -55.6(8)
C17 C18 C19 C20 54.5(9)
C18 C19 C20 C15 -54.3(9)
C20 C15 C16 C17 -56.9(7)
C24 C25 C26 C27 -179.3(8)
C24 C25 C30 C29 -179.5(10)
C25 C26 C27 C28 -53.0(15)
C26 C25 C30 C29 -53.0(13)
C26 C27 C28 C29 52.7(18)
C27 C28 C29 C30 -50.7(19)
C28 C29 C30 C25 50.2(16)
C30 C25 C26 C27 53.0(12)
C31 P1 C37 C38 14.5(5)
C31 P1 C37 C42 -164.4(4)
C31 P1 C43 C44 90.0(4)
C31 P1 C43 C48 -91.4(5)
C31 C32 C33 C34 -1.5(8)
C32 C31 C36 C35 1.8(8)
C32 C33 C34 C35 0.7(9)
C33 C34 C35 C36 1.3(10)
C34 C35 C36 C31 -2.6(9)
C36 C31 C32 C33 0.2(7)
C37 P1 C31 C32 -92.5(4)
C37 P1 C31 C36 87.8(4)
C37 P1 C43 C44 -162.7(4)
C37 P1 C43 C48 15.9(5)
C37 C38 C39 C40 0.4(9)
C38 C37 C42 C41 1.4(8)
C38 C39 C40 C41 -0.7(10)
C39 C40 C41 C42 1.4(11)
C40 C41 C42 C37 -1.7(10)
C42 C37 C38 C39 -0.7(8)
C43 P1 C31 C32 15.0(5)
C43 P1 C31 C36 -164.7(4)
C43 P1 C37 C38 -93.0(5)
C43 P1 C37 C42 88.1(4)
C43 C44 C45 C46 -1.7(10)
C44 C43 C48 C47 0.0(8)
C44 C45 C46 C47 1.0(10)
C45 C46 C47 C48 0.2(10)
C46 C47 C48 C43 -0.7(9)
C48 C43 C44 C45 1.2(8)
C49 P2 C55 C56 -78.8(5)
C49 P2 C55 C60 104.3(5)
C49 P2 C61 C62 -15.6(5)
C49 P2 C61 C66 168.5(4)
C49 C50 C51 C52 -0.7(8)
C50 C49 C54 C53 -0.1(8)
C50 C51 C52 C53 0.4(9)
C51 C52 C53 C54 0.0(9)
C52 C53 C54 C49 -0.2(9)
C54 C49 C50 C51 0.6(8)
C55 P2 C49 C50 148.6(4)
C55 P2 C49 C54 -33.4(5)
C55 P2 C61 C62 92.0(5)
C55 P2 C61 C66 -83.8(5)
C55 C56 C57 C58 0.5(10)
C56 C55 C60 C59 0.2(8)
C56 C57 C58 C59 0.1(11)
C57 C58 C59 C60 -0.5(10)
C58 C59 C60 C55 0.4(9)
C60 C55 C56 C57 -0.7(9)
C61 P2 C49 C50 -104.7(4)
C61 P2 C49 C54 73.3(5)
C61 P2 C55 C56 173.6(4)
C61 P2 C55 C60 -3.2(5)
C61 C62 C63 C64 1.1(8)
C62 C61 C66 C65 0.8(9)
C62 C63 C64 C65 -0.3(9)
C63 C64 C65 C66 -0.2(10)
C64 C65 C66 C61 -0.1(10)
C66 C61 C62 C63 -1.3(8)
C67 P3 C73 C74 -77.6(5)
C67 P3 C73 C78 100.7(5)
C67 P3 C79 C80 -160.7(5)
C67 P3 C79 C84 20.8(6)
C67 C68 C69 C70 1.8(10)
C68 C67 C72 C71 0.6(8)
C68 C69 C70 C71 -0.7(10)
C69 C70 C71 C72 -0.3(9)
C70 C71 C72 C67 0.4(9)
C72 C67 C68 C69 -1.6(9)
C73 P3 C67 C68 18.3(6)
C73 P3 C67 C72 -158.6(4)
C73 P3 C79 C80 90.4(5)
C73 P3 C79 C84 -88.1(5)
C73 C74 C75 C76 -1.3(10)
C74 C73 C78 C77 0.3(9)
C74 C75 C76 C77 2.0(11)
C75 C76 C77 C78 -1.6(10)
C76 C77 C78 C73 0.4(9)
C78 C73 C74 C75 0.2(9)
C79 P3 C67 C68 -88.4(5)
C79 P3 C67 C72 94.6(5)
C79 P3 C73 C74 31.9(5)
C79 P3 C73 C78 -149.8(4)
C79 C80 C81 C82 0.0(11)
C80 C79 C84 C83 -1.9(9)
C80 C81 C82 C83 -1.0(12)
C81 C82 C83 C84 0.5(12)
C82 C83 C84 C79 1.0(11)
C84 C79 C80 C81 1.4(9)
C85 P4 C91 C92 -86.4(5)
C85 P4 C91 C96 91.3(4)
C85 P4 C97 C98 15.7(5)
C85 P4 C97 C102 -164.1(4)
C85 C86 C87 C88 1.6(10)
C86 C85 C90 C89 1.2(8)
C86 C87 C88 C89 -0.4(10)
C87 C88 C89 C90 -0.4(10)
C88 C89 C90 C85 0.0(9)
C90 C85 C86 C87 -2.0(8)
C91 P4 C85 C86 -4.7(5)
C91 P4 C85 C90 177.0(4)
C91 P4 C97 C98 -92.1(5)
C91 P4 C97 C102 88.1(5)
C91 C92 C93 C94 -0.3(9)
C92 C91 C96 C95 2.3(9)
C92 C93 C94 C95 2.0(9)
C93 C94 C95 C96 -1.5(10)
C94 C95 C96 C91 -0.6(10)
C96 C91 C92 C93 -1.9(8)
C97 P4 C85 C86 -113.7(5)
C97 P4 C85 C90 68.1(5)
C97 P4 C91 C92 21.8(5)
C97 P4 C91 C96 -160.5(4)
C97 C98 C99 C100 -2.3(9)
C98 C97 C102 C101 0.7(8)
C98 C99 C100 C101 2.0(9)
C99 C100 C101 C102 -0.3(9)
C100 C101 C102 C97 -1.0(9)
C102 C97 C98 C99 0.9(8)
C104 C105 O5 C106 179.3(11)
C105 O5 C106 C107 171.4(12)
