#------------------------------------------------------------------------------
#$Date: 2016-03-26 19:25:55 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180434 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/03/7210385.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_7210385
loop_
_publ_author_name
'Li, Bing'
'Liao, Jian-Hong'
'Li, Yi-Juan'
'Liu, C. W.'
_publ_section_title
;
 Dihalogen-templated synthesis of dodecanuclear silver
 dichalcogenophosphate clusters
;
_journal_issue                   31
_journal_name_full               CrystEngComm
_journal_page_first              6140
_journal_paper_doi               10.1039/c3ce40829a
_journal_volume                  15
_journal_year                    2013
_chemical_formula_sum            'C40 H100 Ag12 I2 O20 P10 S20'
_chemical_formula_weight         3400.34
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                100.256(3)
_cell_angle_beta                 102.841(3)
_cell_angle_gamma                110.851(3)
_cell_formula_units_Z            1
_cell_length_a                   12.767(2)
_cell_length_b                   13.476(2)
_cell_length_c                   16.931(3)
_cell_measurement_reflns_used    5610
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      25.71
_cell_measurement_theta_min      2.33
_cell_volume                     2546.2(7)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.979
_diffrn_measured_fraction_theta_max 0.979
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0476
_diffrn_reflns_av_sigmaI/netI    0.0742
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            24365
_diffrn_reflns_theta_full        26.76
_diffrn_reflns_theta_max         26.76
_diffrn_reflns_theta_min         1.29
_exptl_absorpt_coefficient_mu    3.475
_exptl_absorpt_correction_T_max  0.7450
_exptl_absorpt_correction_T_min  0.5289
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.218
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1640
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.09
_refine_diff_density_max         1.269
_refine_diff_density_min         -1.598
_refine_diff_density_rms         0.157
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.012
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     451
_refine_ls_number_reflns         10620
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.014
_refine_ls_R_factor_all          0.1181
_refine_ls_R_factor_gt           0.0538
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0874P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1450
_refine_ls_wR_factor_ref         0.1784
_reflns_number_gt                5634
_reflns_number_total             10620
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3ce40829a.txt
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 
;
_cod_original_cell_volume        2546.3(8)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7210385
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Ag1 Ag 0.50747(7) 0.70650(7) 0.34441(5) 0.0668(2) Uani 1 1 d .
Ag2 Ag 0.28430(9) 0.71535(8) 0.21429(7) 0.0891(3) Uani 1 1 d .
Ag3 Ag 0.45006(8) 0.93230(8) 0.17929(6) 0.0755(3) Uani 1 1 d .
Ag4 Ag 0.32896(7) 1.04506(7) 0.29069(5) 0.0667(2) Uani 1 1 d .
Ag5 Ag 0.63701(7) 0.95621(7) 0.34766(5) 0.0644(2) Uani 1 1 d .
Ag6 Ag 0.44326(9) 0.80938(11) 0.51244(6) 0.0928(4) Uani 1 1 d .
I1 I 0.40929(5) 0.89784(5) 0.37479(4) 0.05105(18) Uani 1 1 d .
S1 S 0.1339(3) 0.5920(2) 0.2637(2) 0.0788(9) Uani 1 1 d .
S2 S 0.3718(2) 0.5897(2) 0.40881(17) 0.0646(7) Uani 1 1 d .
S3 S 0.4414(3) 0.6337(2) 0.18376(17) 0.0655(7) Uani 1 1 d .
S4 S 0.6323(2) 0.8959(2) 0.19136(16) 0.0624(7) Uani 1 1 d .
S5 S 0.4819(2) 1.1316(2) 0.21679(17) 0.0597(7) Uani 1 1 d .
S6 S 0.6919(2) 1.1681(2) 0.40201(16) 0.0526(6) Uani 1 1 d .
S7 S 0.36020(19) 1.1991(2) 0.41931(15) 0.0495(6) Uani 1 1 d .
S8 S 0.7290(2) 0.8293(2) 0.40701(14) 0.0512(6) Uani 1 1 d .
S9 S 0.2574(2) 0.7851(2) 0.08511(17) 0.0676(7) Uani 1 1 d .
S10 S 0.1268(3) 0.9154(3) 0.1969(2) 0.0868(10) Uani 1 1 d .
P1 P 0.2162(2) 0.5097(2) 0.31596(18) 0.0564(7) Uani 1 1 d .
P2 P 0.5746(3) 0.7307(3) 0.15407(19) 0.0713(8) Uani 1 1 d .
P3 P 0.6461(2) 1.2123(2) 0.29831(17) 0.0568(6) Uani 1 1 d .
P4 P 0.23510(19) 1.1239(2) 0.46775(14) 0.0447(5) Uani 1 1 d .
P5 P 0.1328(2) 0.8437(2) 0.08827(17) 0.0630(7) Uani 1 1 d .
O1 O 0.1305(7) 0.4243(6) 0.3512(5) 0.081(2) Uani 1 1 d .
O2 O 0.2274(6) 0.4284(6) 0.2415(4) 0.0676(19) Uani 1 1 d .
O3 O 0.6815(8) 0.6981(9) 0.1966(8) 0.131(4) Uani 1 1 d .
O4 O 0.5650(10) 0.6917(10) 0.0632(6) 0.136(4) Uani 1 1 d DU
O5 O 0.7381(7) 1.2034(7) 0.2527(5) 0.085(2) Uani 1 1 d .
O6 O 0.6793(8) 1.3392(6) 0.3200(5) 0.088(2) Uani 1 1 d .
O7 O 0.1225(6) 1.1467(6) 0.4340(4) 0.0580(17) Uani 1 1 d .
O8 O 0.1966(5) 0.9972(5) 0.4330(4) 0.0578(17) Uani 1 1 d .
O9 O 0.0084(8) 0.7458(8) 0.0453(7) 0.128(4) Uani 1 1 d .
O10 O 0.1280(12) 0.9052(10) 0.0216(7) 0.139(4) Uani 1 1 d D
C1 C 0.0896(16) 0.4593(14) 0.4158(11) 0.134(7) Uani 1 1 d .
H1A H 0.0353 0.4904 0.3941 0.161 Uiso 1 1 calc R
H1B H 0.1560 0.5181 0.4604 0.161 Uiso 1 1 calc R
C2 C 0.0329(19) 0.3775(14) 0.4509(13) 0.161(9) Uani 1 1 d .
H2A H 0.0069 0.4089 0.4940 0.242 Uiso 1 1 calc R
H2B H 0.0868 0.3482 0.4751 0.242 Uiso 1 1 calc R
H2C H -0.0338 0.3191 0.4077 0.242 Uiso 1 1 calc R
C3 C 0.2894(12) 0.3599(10) 0.2557(9) 0.090(4) Uani 1 1 d .
H3A H 0.3711 0.3986 0.2589 0.108 Uiso 1 1 calc R
H3B H 0.2876 0.3425 0.3087 0.108 Uiso 1 1 calc R
C4 C 0.2348(19) 0.2606(13) 0.1882(10) 0.154(9) Uani 1 1 d .
H4A H 0.2758 0.2142 0.1974 0.231 Uiso 1 1 calc R
H4B H 0.2378 0.2782 0.1360 0.231 Uiso 1 1 calc R
H4C H 0.1542 0.2225 0.1855 0.231 Uiso 1 1 calc R
C5 C 0.7904(15) 0.7319(18) 0.1926(12) 0.143(5) Uani 1 1 d .
H5A H 0.8410 0.7979 0.2389 0.171 Uiso 1 1 calc R
H5B H 0.7917 0.7514 0.1402 0.171 Uiso 1 1 calc R
C6 C 0.8354(15) 0.6495(16) 0.1966(13) 0.146(7) Uani 1 1 d .
H6A H 0.9147 0.6777 0.1942 0.219 Uiso 1 1 calc R
H6B H 0.7870 0.5848 0.1498 0.219 Uiso 1 1 calc R
H6C H 0.8348 0.6303 0.2485 0.219 Uiso 1 1 calc R
C7 C 0.4708(14) 0.6798(18) -0.0044(10) 0.143(5) Uani 1 1 d DU
H7A H 0.4692 0.7514 -0.0036 0.171 Uiso 1 1 calc R
H7B H 0.3969 0.6317 0.0007 0.171 Uiso 1 1 calc R
C8 C 0.485(2) 0.6317(15) -0.0851(9) 0.162(9) Uani 1 1 d U
H8A H 0.4213 0.6239 -0.1315 0.243 Uiso 1 1 calc R
H8B H 0.4857 0.5604 -0.0859 0.243 Uiso 1 1 calc R
H8C H 0.5585 0.6798 -0.0899 0.243 Uiso 1 1 calc R
C9 C 0.7405(16) 1.2211(17) 0.1718(11) 0.133(6) Uani 1 1 d .
H9A H 0.7202 1.1507 0.1320 0.160 Uiso 1 1 calc R
H9B H 0.6805 1.2471 0.1522 0.160 Uiso 1 1 calc R
C10 C 0.8450(18) 1.294(2) 0.1715(12) 0.233(16) Uani 1 1 d .
H10A H 0.8396 1.3006 0.1153 0.350 Uiso 1 1 calc R
H10B H 0.9051 1.2686 0.1898 0.350 Uiso 1 1 calc R
H10C H 0.8648 1.3650 0.2090 0.350 Uiso 1 1 calc R
C11 C 0.6135(15) 1.3864(13) 0.3539(10) 0.110(5) Uani 1 1 d .
H11A H 0.6200 1.3783 0.4104 0.132 Uiso 1 1 calc R
H11B H 0.5313 1.3460 0.3201 0.132 Uiso 1 1 calc R
C12 C 0.6498(17) 1.5066(12) 0.3585(14) 0.151(8) Uani 1 1 d .
H12A H 0.6005 1.5337 0.3827 0.227 Uiso 1 1 calc R
H12B H 0.6415 1.5153 0.3027 0.227 Uiso 1 1 calc R
H12C H 0.7305 1.5477 0.3931 0.227 Uiso 1 1 calc R
C13 C 0.0702(10) 1.1283(12) 0.3435(7) 0.084(4) Uani 1 1 d .
H13A H 0.0956 1.1985 0.3303 0.101 Uiso 1 1 calc R
H13B H 0.0980 1.0812 0.3117 0.101 Uiso 1 1 calc R
C14 C -0.0567(10) 1.0771(14) 0.3185(8) 0.108(5) Uani 1 1 d .
H14A H -0.0882 1.0660 0.2590 0.162 Uiso 1 1 calc R
H14B H -0.0845 1.1243 0.3490 0.162 Uiso 1 1 calc R
H14C H -0.0821 1.0071 0.3307 0.162 Uiso 1 1 calc R
C15 C 0.0994(9) 0.9170(8) 0.4523(7) 0.068(3) Uani 1 1 d .
H15A H 0.1222 0.9220 0.5120 0.082 Uiso 1 1 calc R
H15B H 0.0305 0.9334 0.4390 0.082 Uiso 1 1 calc R
C16 C 0.0717(13) 0.8072(10) 0.4031(8) 0.099(4) Uani 1 1 d .
H16A H 0.0082 0.7546 0.4154 0.149 Uiso 1 1 calc R
H16B H 0.1399 0.7910 0.4170 0.149 Uiso 1 1 calc R
H16C H 0.0488 0.8025 0.3441 0.149 Uiso 1 1 calc R
C17 C -0.0311(18) 0.6478(16) -0.0121(14) 0.159(5) Uani 1 1 d U
H17A H 0.0264 0.6172 0.0027 0.190 Uiso 1 1 calc R
H17B H -0.0287 0.6630 -0.0658 0.190 Uiso 1 1 calc R
C18 C -0.1420(16) 0.5633(15) -0.0269(12) 0.144(4) Uani 1 1 d U
H18A H -0.1528 0.4995 -0.0690 0.216 Uiso 1 1 calc R
H18B H -0.2021 0.5883 -0.0464 0.216 Uiso 1 1 calc R
H18C H -0.1473 0.5443 0.0245 0.216 Uiso 1 1 calc R
C19 C 0.2064(16) 1.0059(14) 0.0190(14) 0.159(5) Uani 1 1 d DU
H19A H 0.2731 0.9958 0.0065 0.190 Uiso 1 1 calc R
H19B H 0.2357 1.0575 0.0748 0.190 Uiso 1 1 calc R
C20 C 0.1619(17) 1.0550(16) -0.0399(12) 0.144(4) Uani 1 1 d U
H20A H 0.2233 1.1240 -0.0363 0.216 Uiso 1 1 calc R
H20B H 0.0975 1.0681 -0.0273 0.216 Uiso 1 1 calc R
H20C H 0.1349 1.0062 -0.0959 0.216 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 0.0033 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'
S S 0.1246 0.1234 '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'
I I -0.4742 1.8119 '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
S2 Ag1 S3 112.76(10) . .
S2 Ag1 S8 129.41(9) . .
S3 Ag1 S8 112.58(9) . .
S2 Ag1 Ag5 141.13(8) . .
S3 Ag1 Ag5 94.32(7) . .
S8 Ag1 Ag5 53.10(6) . .
S2 Ag1 Ag2 89.83(7) . .
S3 Ag1 Ag2 54.09(7) . .
S8 Ag1 Ag2 135.72(7) . .
Ag5 Ag1 Ag2 83.99(3) . .
S2 Ag1 I1 92.08(7) . .
S3 Ag1 I1 102.91(7) . .
S8 Ag1 I1 98.67(6) . .
Ag5 Ag1 I1 53.60(3) . .
Ag2 Ag1 I1 54.56(3) . .
S2 Ag1 Ag6 56.65(7) . .
S3 Ag1 Ag6 146.15(7) . .
S8 Ag1 Ag6 94.14(6) . .
Ag5 Ag1 Ag6 85.22(3) . .
Ag2 Ag1 Ag6 92.34(4) . .
I1 Ag1 Ag6 50.63(2) . .
S1 Ag2 S9 129.23(11) . .
S1 Ag2 S3 112.92(10) . .
S9 Ag2 S3 96.75(10) . .
S1 Ag2 I1 97.44(9) . .
S9 Ag2 I1 112.82(7) . .
S3 Ag2 I1 106.64(7) . .
S1 Ag2 Ag3 160.90(9) . .
S9 Ag2 Ag3 49.98(7) . .
S3 Ag2 Ag3 85.10(7) . .
I1 Ag2 Ag3 70.17(3) . .
S1 Ag2 Ag1 95.32(8) . .
S9 Ag2 Ag1 134.31(8) . .
S3 Ag2 Ag1 49.77(6) . .
I1 Ag2 Ag1 62.90(3) . .
Ag3 Ag2 Ag1 91.77(4) . .
S9 Ag3 S5 121.12(9) . .
S9 Ag3 S4 118.60(10) . .
S5 Ag3 S4 116.19(9) . .
S9 Ag3 Ag5 135.19(8) . .
S5 Ag3 Ag5 94.90(6) . .
S4 Ag3 Ag5 53.12(6) . .
S9 Ag3 Ag2 51.25(7) . .
S5 Ag3 Ag2 134.51(8) . .
S4 Ag3 Ag2 99.85(7) . .
Ag5 Ag3 Ag2 84.89(3) . .
S9 Ag3 Ag4 92.87(7) . .
S5 Ag3 Ag4 52.43(7) . .
S4 Ag3 Ag4 141.38(7) . .
Ag5 Ag3 Ag4 89.08(3) . .
Ag2 Ag3 Ag4 82.12(4) . .
S10 Ag4 S7 120.99(10) . .
S10 Ag4 S5 116.58(11) . .
S7 Ag4 S5 107.04(9) . .
S10 Ag4 I1 102.22(10) . .
S7 Ag4 I1 101.05(6) . .
S5 Ag4 I1 106.69(6) . .
S10 Ag4 Ag3 92.37(8) . .
S7 Ag4 Ag3 146.62(6) . .
S5 Ag4 Ag3 50.03(7) . .
I1 Ag4 Ag3 70.16(3) . .
S4 Ag5 S8 98.38(9) . .
S4 Ag5 S6 112.68(9) . .
S8 Ag5 S6 131.50(8) . .
S4 Ag5 I1 115.67(6) . .
S8 Ag5 I1 107.22(6) . .
S6 Ag5 I1 92.19(6) . .
S4 Ag5 Ag1 90.97(7) . .
S8 Ag5 Ag1 51.66(6) . .
S6 Ag5 Ag1 153.04(7) . .
I1 Ag5 Ag1 64.87(3) . .
S4 Ag5 Ag3 50.55(6) . .
S8 Ag5 Ag3 136.15(6) . .
S6 Ag5 Ag3 91.90(6) . .
I1 Ag5 Ag3 71.48(3) . .
Ag1 Ag5 Ag3 93.71(3) . .
S6 Ag6 S7 121.56(9) 2_676 2_676
S6 Ag6 I1 109.71(6) 2_676 .
S7 Ag6 I1 122.39(7) 2_676 .
S6 Ag6 S2 115.21(9) 2_676 .
S7 Ag6 S2 86.76(8) 2_676 .
I1 Ag6 S2 94.35(6) . .
S6 Ag6 Ag1 155.56(7) 2_676 .
S7 Ag6 Ag1 77.86(6) 2_676 .
I1 Ag6 Ag1 63.21(3) . .
S2 Ag6 Ag1 46.50(6) . .
Ag6 I1 Ag5 100.74(3) . .
Ag6 I1 Ag4 151.05(4) . .
Ag5 I1 Ag4 99.08(3) . .
Ag6 I1 Ag2 109.90(4) . .
Ag5 I1 Ag2 93.73(3) . .
Ag4 I1 Ag2 89.56(3) . .
Ag6 I1 Ag1 66.16(3) . .
Ag5 I1 Ag1 61.53(3) . .
Ag4 I1 Ag1 142.66(3) . .
Ag2 I1 Ag1 62.54(3) . .
P1 S1 Ag2 102.34(15) . .
P1 S2 Ag1 104.93(14) . .
P1 S2 Ag6 122.04(14) . .
Ag1 S2 Ag6 76.85(8) . .
P2 S3 Ag1 102.82(14) . .
P2 S3 Ag2 116.83(16) . .
Ag1 S3 Ag2 76.13(8) . .
P2 S4 Ag3 105.51(14) . .
P2 S4 Ag5 108.75(15) . .
Ag3 S4 Ag5 76.33(8) . .
P3 S5 Ag3 104.73(13) . .
P3 S5 Ag4 111.94(13) . .
Ag3 S5 Ag4 77.54(8) . .
P3 S6 Ag6 106.89(13) . 2_676
P3 S6 Ag5 104.58(13) . .
Ag6 S6 Ag5 107.54(9) 2_676 .
P4 S7 Ag6 112.06(12) . 2_676
P4 S7 Ag4 103.04(12) . .
Ag6 S7 Ag4 87.76(8) 2_676 .
P4 S8 Ag1 107.00(12) 2_676 .
P4 S8 Ag5 106.49(12) 2_676 .
Ag1 S8 Ag5 75.25(7) . .
P5 S9 Ag3 107.85(14) . .
P5 S9 Ag2 105.10(15) . .
Ag3 S9 Ag2 78.77(8) . .
P5 S10 Ag4 110.42(16) . .
O2 P1 O1 101.1(4) . .
O2 P1 S1 106.9(3) . .
O1 P1 S1 109.1(3) . .
O2 P1 S2 110.2(3) . .
O1 P1 S2 106.7(3) . .
S1 P1 S2 121.01(17) . .
O4 P2 O3 98.8(7) . .
O4 P2 S3 112.5(5) . .
O3 P2 S3 102.4(4) . .
O4 P2 S4 110.6(5) . .
O3 P2 S4 108.3(4) . .
S3 P2 S4 121.24(18) . .
O6 P3 O5 101.0(5) . .
O6 P3 S6 110.8(3) . .
O5 P3 S6 103.5(3) . .
O6 P3 S5 109.0(4) . .
O5 P3 S5 110.0(4) . .
S6 P3 S5 120.58(16) . .
O8 P4 O7 106.4(4) . .
O8 P4 S7 107.0(3) . .
O7 P4 S7 110.1(3) . .
O8 P4 S8 111.9(3) . 2_676
O7 P4 S8 103.2(3) . 2_676
S7 P4 S8 117.70(15) . 2_676
O10 P5 O9 97.3(7) . .
O10 P5 S10 116.0(5) . .
O9 P5 S10 104.9(5) . .
O10 P5 S9 107.7(5) . .
O9 P5 S9 108.9(4) . .
S10 P5 S9 119.45(17) . .
C1 O1 P1 121.7(9) . .
C3 O2 P1 122.9(7) . .
C5 O3 P2 129.6(13) . .
C7 O4 P2 123.8(12) . .
C9 O5 P3 126.3(9) . .
C11 O6 P3 122.5(9) . .
C13 O7 P4 120.9(6) . .
C15 O8 P4 121.0(6) . .
C17 O9 P5 133.5(13) . .
C19 O10 P5 130.9(14) . .
O1 C1 C2 115.4(15) . .
O1 C1 H1A 108.4 . .
C2 C1 H1A 108.4 . .
O1 C1 H1B 108.4 . .
C2 C1 H1B 108.4 . .
H1A C1 H1B 107.5 . .
C1 C2 H2A 109.5 . .
C1 C2 H2B 109.5 . .
H2A C2 H2B 109.5 . .
C1 C2 H2C 109.5 . .
H2A C2 H2C 109.5 . .
H2B C2 H2C 109.5 . .
C4 C3 O2 109.1(12) . .
C4 C3 H3A 109.9 . .
O2 C3 H3A 109.9 . .
C4 C3 H3B 109.9 . .
O2 C3 H3B 109.9 . .
H3A C3 H3B 108.3 . .
C3 C4 H4A 109.5 . .
C3 C4 H4B 109.5 . .
H4A C4 H4B 109.5 . .
C3 C4 H4C 109.5 . .
H4A C4 H4C 109.5 . .
H4B C4 H4C 109.5 . .
O3 C5 C6 112.2(18) . .
O3 C5 H5A 109.2 . .
C6 C5 H5A 109.2 . .
O3 C5 H5B 109.2 . .
C6 C5 H5B 109.2 . .
H5A C5 H5B 107.9 . .
C5 C6 H6A 109.5 . .
C5 C6 H6B 109.5 . .
H6A C6 H6B 109.5 . .
C5 C6 H6C 109.5 . .
H6A C6 H6C 109.5 . .
H6B C6 H6C 109.5 . .
O4 C7 C8 109.3(14) . .
O4 C7 H7A 109.8 . .
C8 C7 H7A 109.8 . .
O4 C7 H7B 109.8 . .
C8 C7 H7B 109.8 . .
H7A C7 H7B 108.3 . .
C7 C8 H8A 109.5 . .
C7 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
C7 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
C10 C9 O5 114.6(16) . .
C10 C9 H9A 108.6 . .
O5 C9 H9A 108.6 . .
C10 C9 H9B 108.6 . .
O5 C9 H9B 108.6 . .
H9A C9 H9B 107.6 . .
C9 C10 H10A 109.5 . .
C9 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
C9 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
O6 C11 C12 114.1(15) . .
O6 C11 H11A 108.7 . .
C12 C11 H11A 108.7 . .
O6 C11 H11B 108.7 . .
C12 C11 H11B 108.7 . .
H11A C11 H11B 107.6 . .
C11 C12 H12A 109.5 . .
C11 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
C11 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
C14 C13 O7 111.5(10) . .
C14 C13 H13A 109.3 . .
O7 C13 H13A 109.3 . .
C14 C13 H13B 109.3 . .
O7 C13 H13B 109.3 . .
H13A C13 H13B 108.0 . .
C13 C14 H14A 109.5 . .
C13 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
C13 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
C16 C15 O8 109.2(9) . .
C16 C15 H15A 109.8 . .
O8 C15 H15A 109.8 . .
C16 C15 H15B 109.8 . .
O8 C15 H15B 109.8 . .
H15A C15 H15B 108.3 . .
C15 C16 H16A 109.5 . .
C15 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C15 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
O9 C17 C18 122(2) . .
O9 C17 H17A 106.8 . .
C18 C17 H17A 106.8 . .
O9 C17 H17B 106.8 . .
C18 C17 H17B 106.8 . .
H17A C17 H17B 106.6 . .
C17 C18 H18A 109.5 . .
C17 C18 H18B 109.5 . .
H18A C18 H18B 109.5 . .
C17 C18 H18C 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
O10 C19 C20 116.4(16) . .
O10 C19 H19A 108.2 . .
C20 C19 H19A 108.2 . .
O10 C19 H19B 108.2 . .
C20 C19 H19B 108.2 . .
H19A C19 H19B 107.3 . .
C19 C20 H20A 109.5 . .
C19 C20 H20B 109.5 . .
H20A C20 H20B 109.5 . .
C19 C20 H20C 109.5 . .
H20A C20 H20C 109.5 . .
H20B C20 H20C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 S2 2.485(3) .
Ag1 S3 2.552(3) .
Ag1 S8 2.564(3) .
Ag1 Ag5 3.1613(13) .
Ag1 Ag2 3.2452(13) .
Ag1 I1 3.2557(11) .
Ag1 Ag6 3.3360(14) .
Ag2 S1 2.468(3) .
Ag2 S9 2.533(3) .
Ag2 S3 2.707(3) .
Ag2 I1 2.9796(13) .
Ag2 Ag3 3.1854(15) .
Ag3 S9 2.487(3) .
Ag3 S5 2.507(3) .
Ag3 S4 2.517(3) .
Ag3 Ag5 3.1668(12) .
Ag3 Ag4 3.1945(13) .
Ag4 S10 2.493(3) .
Ag4 S7 2.574(3) .
Ag4 S5 2.593(3) .
Ag4 I1 2.9699(11) .
Ag5 S4 2.607(3) .
Ag5 S8 2.614(2) .
Ag5 S6 2.617(3) .
Ag5 I1 2.8943(12) .
Ag6 S6 2.548(3) 2_676
Ag6 S7 2.571(2) 2_676
Ag6 I1 2.8193(11) .
Ag6 S2 2.862(3) .
S1 P1 1.970(4) .
S2 P1 2.016(4) .
S3 P2 1.971(4) .
S4 P2 2.006(4) .
S5 P3 2.010(4) .
S6 P3 1.985(4) .
S6 Ag6 2.548(3) 2_676
S7 P4 1.994(3) .
S7 Ag6 2.571(2) 2_676
S8 P4 1.998(3) 2_676
S9 P5 2.017(4) .
S10 P5 1.951(4) .
P1 O2 1.583(7) .
P1 O1 1.586(8) .
P2 O4 1.497(10) .
P2 O3 1.635(10) .
P3 O6 1.559(8) .
P3 O5 1.569(8) .
P4 O8 1.555(7) .
P4 O7 1.580(6) .
P4 S8 1.998(3) 2_676
P5 O10 1.518(10) .
P5 O9 1.564(9) .
O1 C1 1.392(16) .
O2 C3 1.433(12) .
O3 C5 1.321(18) .
O4 C7 1.403(9) .
O5 C9 1.436(17) .
O6 C11 1.380(16) .
O7 C13 1.464(12) .
O8 C15 1.472(12) .
O9 C17 1.34(2) .
O10 C19 1.386(9) .
C1 C2 1.40(2) .
C1 H1A 0.9700 .
C1 H1B 0.9700 .
C2 H2A 0.9600 .
C2 H2B 0.9600 .
C2 H2C 0.9600 .
C3 C4 1.421(18) .
C3 H3A 0.9700 .
C3 H3B 0.9700 .
C4 H4A 0.9600 .
C4 H4B 0.9600 .
C4 H4C 0.9600 .
C5 C6 1.43(2) .
C5 H5A 0.9700 .
C5 H5B 0.9700 .
C6 H6A 0.9600 .
C6 H6B 0.9600 .
C6 H6C 0.9600 .
C7 C8 1.48(2) .
C7 H7A 0.9700 .
C7 H7B 0.9700 .
C8 H8A 0.9600 .
C8 H8B 0.9600 .
C8 H8C 0.9600 .
C9 C10 1.35(2) .
C9 H9A 0.9700 .
C9 H9B 0.9700 .
C10 H10A 0.9600 .
C10 H10B 0.9600 .
C10 H10C 0.9600 .
C11 C12 1.50(2) .
C11 H11A 0.9700 .
C11 H11B 0.9700 .
C12 H12A 0.9600 .
C12 H12B 0.9600 .
C12 H12C 0.9600 .
C13 C14 1.441(16) .
C13 H13A 0.9700 .
C13 H13B 0.9700 .
C14 H14A 0.9600 .
C14 H14B 0.9600 .
C14 H14C 0.9600 .
C15 C16 1.438(15) .
C15 H15A 0.9700 .
C15 H15B 0.9700 .
C16 H16A 0.9600 .
C16 H16B 0.9600 .
C16 H16C 0.9600 .
C17 C18 1.40(2) .
C17 H17A 0.9700 .
C17 H17B 0.9700 .
C18 H18A 0.9600 .
C18 H18B 0.9600 .
C18 H18C 0.9600 .
C19 C20 1.42(2) .
C19 H19A 0.9700 .
C19 H19B 0.9700 .
C20 H20A 0.9600 .
C20 H20B 0.9600 .
C20 H20C 0.9600 .
