#------------------------------------------------------------------------------
#$Date: 2016-01-09 12:32:52 +0200 (Sat, 09 Jan 2016) $
#$Revision: 173758 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/30/7223003.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_7223003
loop_
_publ_author_name
'Yu, Tanlai'
'Fu, Yangbo'
'Wang, Yilin'
'Hao, Pengfei'
'Shen, Junju'
'Fu, Yunlong'
_publ_section_title
;
 Hierarchical symmetry transfer and flexible charge matching in five
 [M(phen)3]2+directed iodoargentates with 1 to 3D frameworks
;
_journal_issue                   45
_journal_name_full               CrystEngComm
_journal_page_first              8752
_journal_paper_doi               10.1039/C5CE01692D
_journal_volume                  17
_journal_year                    2015
_chemical_formula_moiety         '3(Ag8 I11), 4(C36 H24 Co N6), 2(H2 O)'
_chemical_formula_sum            'C144 H100 Ag24 Co4 I33 N24 O2'
_chemical_formula_weight         9210.77
_chemical_name_systematic
;
 ?
;
_space_group_crystal_system      hexagonal
_space_group_IT_number           176
_space_group_name_Hall           '-P 6c'
_space_group_name_H-M_alt        'P 63/m'
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2014
_audit_update_record
;
2015-10-04 deposited with the CCDC.
2015-10-21 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   14.8402(4)
_cell_length_b                   14.8402(4)
_cell_length_c                   24.9918(8)
_cell_measurement_reflns_used    3355
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.2370
_cell_measurement_theta_min      3.1970
_cell_volume                     4766.6(2)
_computing_cell_refinement
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_data_collection
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_data_reduction
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXL-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 16.0710
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0299
_diffrn_reflns_av_unetI/netI     0.0282
_diffrn_reflns_laue_measured_fraction_full 0.998
_diffrn_reflns_laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       7
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            10820
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.994
_diffrn_reflns_theta_min         2.864
_diffrn_source                   'Enhance (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    8.132
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.68720
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            orange-brown
_exptl_crystal_density_diffrn    3.209
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             4133
_exptl_crystal_size_max          0.190
_exptl_crystal_size_mid          0.130
_exptl_crystal_size_min          0.060
_refine_diff_density_max         2.365
_refine_diff_density_min         -4.083
_refine_diff_density_rms         0.364
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.156
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     195
_refine_ls_number_reflns         3209
_refine_ls_number_restraints     151
_refine_ls_restrained_S_all      1.150
_refine_ls_R_factor_all          0.0901
_refine_ls_R_factor_gt           0.0724
_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)+(0.1311P)²+80.2899P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2319
_refine_ls_wR_factor_ref         0.2486
_reflns_Friedel_coverage         0.000
_reflns_number_gt                2522
_reflns_number_total             3209
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c5ce01692d2.cif
_cod_data_source_block           yu
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 3271 2015-04-21 07:52:19Z andrius 

 Adding full bibliography for 7222998--7223004.cif.
;
_cod_original_cell_volume        4766.6(3)
_cod_database_code               7223003
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.307
_shelx_estimated_absorpt_t_max   0.641
_shelxl_version_number           2014-3
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'-x, -y, z+1/2'
'y, -x+y, z+1/2'
'x-y, x, z+1/2'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'x, y, -z-1/2'
'-y, x-y, -z-1/2'
'-x+y, -x, -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
I2 I 0.79961(4) 0.91585(4) 0.7500 0.03887(14) Uani 1 2 d S TU P
I3 I 0.80869(3) 0.64433(3) 0.66072(2) 0.04963(13) Uani 1 1 d . U .
I4 I 0.47122(5) 0.50589(5) 0.7500 0.0583(2) Uani 1 2 d S TU P
I1 I 1.0000 1.0000 0.58873(3) 0.0654(2) Uani 1 3 d S TU P
Ag1 Ag 0.91494(6) 0.86374(6) 0.67662(3) 0.0847(3) Uani 1 1 d . U .
Ag3 Ag 0.66926(7) 0.52833(7) 0.7500 0.0791(3) Uani 1 2 d S TU P
Ag2 Ag 0.92682(12) 0.63890(12) 0.7500 0.0636(5) Uani 0.5 2 d S TU P
Ag2' Ag 0.88979(14) 0.58448(18) 0.7500 0.1009(7) Uani 0.5 2 d S TU P
I5 I 0.6667 0.3333 0.7500 0.0627(7) Uani 0.5 6 d S TU P
I5' I 0.6667 0.3333 0.72332(12) 0.0431(7) Uani 0.25 3 d S TU P
Co1 Co 0.3333 0.6667 0.53169(5) 0.0272(3) Uani 1 3 d S T P
N2 N 0.2857(3) 0.5285(3) 0.57544(19) 0.0334(11) Uani 1 1 d . U .
C11 C 0.2996(3) 0.4574(4) 0.5485(2) 0.0295(12) Uani 1 1 d . U .
C12 C 0.3551(3) 0.4904(4) 0.4985(2) 0.0296(12) Uani 1 1 d . U .
C7 C 0.2606(4) 0.3536(4) 0.5661(2) 0.0395(14) Uani 1 1 d . U .
C10 C 0.2362(4) 0.5002(4) 0.6221(2) 0.0399(15) Uani 1 1 d . U .
H10 H 0.2276 0.5488 0.6415 0.048 Uiso 1 1 calc R U .
C4 C 0.3698(4) 0.4181(4) 0.4682(2) 0.0364(14) Uani 1 1 d . U .
C3 C 0.4249(4) 0.4532(5) 0.4218(3) 0.0478(16) Uani 1 1 d . U .
H3 H 0.4360 0.4080 0.4008 0.057 Uiso 1 1 calc R U .
C8 C 0.2094(5) 0.3274(5) 0.6165(3) 0.0483(16) Uani 1 1 d . U .
H8 H 0.1850 0.2614 0.6309 0.058 Uiso 1 1 calc R U .
C9 C 0.1965(5) 0.3999(5) 0.6433(3) 0.0491(17) Uani 1 1 d . U .
H9 H 0.1613 0.3829 0.6758 0.059 Uiso 1 1 calc R U .
C6 C 0.2708(5) 0.2828(4) 0.5336(3) 0.0518(17) Uani 1 1 d . U .
H6 H 0.2408 0.2137 0.5443 0.062 Uiso 1 1 calc R U .
C5 C 0.3239(5) 0.3130(4) 0.4867(3) 0.0485(16) Uani 1 1 d . U .
H5 H 0.3306 0.2644 0.4662 0.058 Uiso 1 1 calc R U .
N1 N 0.3925(3) 0.5880(3) 0.48326(18) 0.0292(11) Uani 1 1 d . U .
C1 C 0.4471(4) 0.6198(4) 0.4382(2) 0.0411(15) Uani 1 1 d . U .
H1 H 0.4745 0.6891 0.4284 0.049 Uiso 1 1 calc R U .
C2 C 0.4655(4) 0.5578(4) 0.4055(3) 0.0456(16) Uani 1 1 d . U .
H2 H 0.5029 0.5828 0.3738 0.055 Uiso 1 1 calc R U .
I6 I 0.8719(3) 0.7792(2) 0.7500 0.1482(13) Uani 0.5 2 d S TU P
O1 O 0.6667 0.3333 0.2500 0.24(2) Uani 1 6 d S T P
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co 0.3494 0.9721 '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'
O O 0.0106 0.0060 '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
I6 I2 I6 129.60(10) . 3_675
I6 I2 Ag1 44.72(3) . 10_557
I6 I2 Ag1 103.14(6) 3_675 10_557
I6 I2 Ag1 44.72(3) . .
I6 I2 Ag1 103.14(6) 3_675 .
Ag1 I2 Ag1 79.57(4) 10_557 .
I6 I2 Ag1 102.84(5) . 12_677
I6 I2 Ag1 43.35(4) 3_675 12_677
Ag1 I2 Ag1 62.91(3) 10_557 12_677
Ag1 I2 Ag1 109.06(3) . 12_677
I6 I2 Ag1 102.84(5) . 3_675
I6 I2 Ag1 43.35(4) 3_675 3_675
Ag1 I2 Ag1 109.05(3) 10_557 3_675
Ag1 I2 Ag1 62.91(3) . 3_675
Ag1 I2 Ag1 75.31(3) 12_677 3_675
I6 I2 Ag2 179.25(7) . 3_675
I6 I2 Ag2 51.15(9) 3_675 3_675
Ag1 I2 Ag2 135.59(3) 10_557 3_675
Ag1 I2 Ag2 135.59(3) . 3_675
Ag1 I2 Ag2 77.74(3) 12_677 3_675
Ag1 I2 Ag2 77.74(3) 3_675 3_675
I6 I3 Ag1 44.13(5) . .
I6 I3 Ag2 54.11(9) . .
Ag1 I3 Ag2 85.80(4) . .
I6 I3 Ag2' 64.19(9) . .
Ag1 I3 Ag2' 99.60(5) . .
Ag2 I3 Ag2' 14.29(5) . .
I6 I3 Ag3 72.72(5) . .
Ag1 I3 Ag3 112.85(3) . .
Ag2 I3 Ag3 69.76(3) . .
Ag2' I3 Ag3 60.79(4) . .
Ag2' I4 Ag3 81.54(5) 2_655 .
Ag2' I4 Ag2 14.74(5) 2_655 2_655
Ag3 I4 Ag2 96.28(4) . 2_655
Ag1 I1 Ag1 65.81(3) . 2_765
Ag1 I1 Ag1 65.81(3) . 3_675
Ag1 I1 Ag1 65.81(3) 2_765 3_675
I6 Ag1 I1 170.75(7) . .
I6 Ag1 I3 67.39(7) . .
I1 Ag1 I3 120.30(3) . .
I6 Ag1 I2 64.18(11) . .
I1 Ag1 I2 114.74(3) . .
I3 Ag1 I2 109.50(3) . .
I6 Ag1 I2 61.48(9) . 2_765
I1 Ag1 I2 110.64(2) . 2_765
I3 Ag1 I2 98.97(3) . 2_765
I2 Ag1 I2 99.51(3) . 2_765
I6 Ag1 Ag1 113.84(8) . 2_765
I1 Ag1 Ag1 57.096(15) . 2_765
I3 Ag1 Ag1 140.11(5) . 2_765
I2 Ag1 Ag1 105.58(3) . 2_765
I2 Ag1 Ag1 56.38(3) 2_765 2_765
I6 Ag1 Ag1 118.10(9) . 3_675
I1 Ag1 Ag1 57.096(15) . 3_675
I3 Ag1 Ag1 157.78(5) . 3_675
I2 Ag1 Ag1 60.71(3) . 3_675
I2 Ag1 Ag1 102.31(2) 2_765 3_675
Ag1 Ag1 Ag1 60.0 2_765 3_675
I4 Ag3 I5 113.40(3) . .
I4 Ag3 I3 117.44(3) . .
I5 Ag3 I3 103.91(3) . .
I4 Ag3 I3 117.44(3) . 10_557
I5 Ag3 I3 103.91(3) . 10_557
I3 Ag3 I3 98.60(3) . 10_557
I4 Ag3 Ag2' 171.76(7) . .
I5 Ag3 Ag2' 74.85(6) . .
I3 Ag3 Ag2' 58.52(3) . .
I3 Ag3 Ag2' 58.52(3) 10_557 .
I4 Ag3 I5' 112.76(3) . 10_557
I5 Ag3 I5' 13.06(6) . 10_557
I3 Ag3 I5' 113.93(6) . 10_557
I3 Ag3 I5' 93.60(5) 10_557 10_557
Ag2' Ag3 I5' 75.25(6) . 10_557
I4 Ag3 I5' 112.76(3) . .
I5 Ag3 I5' 13.06(6) . .
I3 Ag3 I5' 93.61(5) . .
I3 Ag3 I5' 113.92(6) 10_557 .
Ag2' Ag3 I5' 75.25(6) . .
I5' Ag3 I5' 26.12(12) 10_557 .
I4 Ag3 Ag2 160.60(5) . .
I5 Ag3 Ag2 86.00(4) . .
I3 Ag3 Ag2 53.99(2) . .
I3 Ag3 Ag2 53.99(2) 10_557 .
Ag2' Ag3 Ag2 11.15(6) . .
I5' Ag3 Ag2 86.10(4) 10_557 .
I5' Ag3 Ag2 86.10(4) . .
Ag2' Ag2 I6 122.4(3) . .
Ag2' Ag2 I4 71.4(3) . 3_665
I6 Ag2 I4 166.18(9) . 3_665
Ag2' Ag2 I3 84.03(17) . 10_557
I6 Ag2 I3 62.21(5) . 10_557
I4 Ag2 I3 123.56(4) 3_665 10_557
Ag2' Ag2 I3 84.03(17) . .
I6 Ag2 I3 62.21(5) . .
I4 Ag2 I3 123.56(4) 3_665 .
I3 Ag2 I3 102.38(6) 10_557 .
Ag2' Ag2 I2 177.6(3) . 2_765
I6 Ag2 I2 55.18(7) . 2_765
I4 Ag2 I2 111.00(5) 3_665 2_765
I3 Ag2 I2 94.45(4) 10_557 2_765
I3 Ag2 I2 94.45(4) . 2_765
Ag2' Ag2 Ag3 52.9(3) . .
I6 Ag2 Ag3 69.49(8) . .
I4 Ag2 Ag3 124.32(6) 3_665 .
I3 Ag2 Ag3 56.24(3) 10_557 .
I3 Ag2 Ag3 56.24(3) . .
I2 Ag2 Ag3 124.68(7) 2_765 .
Ag2 Ag2' I4 93.8(3) . 3_665
Ag2 Ag2' I3 81.68(18) . 10_557
I4 Ag2' I3 128.55(4) 3_665 10_557
Ag2 Ag2' I3 81.68(18) . .
I4 Ag2' I3 128.55(4) 3_665 .
I3 Ag2' I3 101.65(9) 10_557 .
Ag2 Ag2' Ag3 116.0(3) . .
I4 Ag2' Ag3 150.22(9) 3_665 .
I3 Ag2' Ag3 60.69(4) 10_557 .
I3 Ag2' Ag3 60.69(4) . .
Ag2 Ag2' I6 46.1(3) . .
I4 Ag2' I6 139.96(9) 3_665 .
I3 Ag2' I6 57.07(5) 10_557 .
I3 Ag2' I6 57.07(5) . .
Ag3 Ag2' I6 69.82(9) . .
I5' I5 I5' 180.0 . 10_557
I5' I5 Ag3 90.000(1) . .
I5' I5 Ag3 89.995(1) 10_557 .
I5' I5 Ag3 90.000(1) . 3_665
I5' I5 Ag3 90.005(2) 10_557 3_665
Ag3 I5 Ag3 120.000(1) . 3_665
I5' I5 Ag3 90.000(3) . 2_655
I5' I5 Ag3 90.000(2) 10_557 2_655
Ag3 I5 Ag3 120.0 . 2_655
Ag3 I5 Ag3 120.0 3_665 2_655
I5 I5' I5' 0.003(1) . 10_557
I5 I5' Ag3 76.94(6) . .
I5' I5' Ag3 76.94(6) 10_557 .
I5 I5' Ag3 76.94(6) . 3_665
I5' I5' Ag3 76.94(6) 10_557 3_665
Ag3 I5' Ag3 115.05(4) . 3_665
I5 I5' Ag3 76.94(6) . 2_655
I5' I5' Ag3 76.94(6) 10_557 2_655
Ag3 I5' Ag3 115.05(4) . 2_655
Ag3 I5' Ag3 115.05(4) 3_665 2_655
N2 Co1 N2 95.56(17) 3_565 2_665
N2 Co1 N2 95.56(17) 3_565 .
N2 Co1 N2 95.56(17) 2_665 .
N2 Co1 N1 78.08(17) 3_565 3_565
N2 Co1 N1 167.17(16) 2_665 3_565
N2 Co1 N1 96.13(15) . 3_565
N2 Co1 N1 96.13(15) 3_565 2_665
N2 Co1 N1 78.08(17) 2_665 2_665
N2 Co1 N1 167.17(16) . 2_665
N1 Co1 N1 91.42(17) 3_565 2_665
N2 Co1 N1 167.17(16) 3_565 .
N2 Co1 N1 96.13(15) 2_665 .
N2 Co1 N1 78.08(17) . .
N1 Co1 N1 91.42(17) 3_565 .
N1 Co1 N1 91.42(17) 2_665 .
C10 N2 C11 117.8(5) . .
C10 N2 Co1 128.8(4) . .
C11 N2 Co1 113.1(3) . .
N2 C11 C7 123.7(5) . .
N2 C11 C12 116.9(4) . .
C7 C11 C12 119.5(5) . .
N1 C12 C4 122.4(5) . .
N1 C12 C11 118.5(5) . .
C4 C12 C11 119.1(5) . .
C6 C7 C11 120.0(5) . .
C6 C7 C8 123.6(5) . .
C11 C7 C8 116.4(6) . .
N2 C10 C9 122.7(6) . .
C3 C4 C12 117.1(5) . .
C3 C4 C5 124.0(6) . .
C12 C4 C5 118.8(5) . .
C4 C3 C2 120.7(6) . .
C9 C8 C7 119.2(6) . .
C8 C9 C10 120.2(6) . .
C5 C6 C7 121.1(6) . .
C6 C5 C4 121.4(6) . .
C12 N1 C1 118.8(5) . .
C12 N1 Co1 111.8(3) . .
C1 N1 Co1 128.8(4) . .
N1 C1 C2 124.3(5) . .
C1 C2 C3 116.7(6) . .
Ag1 I6 Ag1 118.71(14) 10_557 .
Ag1 I6 Ag2 110.55(12) 10_557 .
Ag1 I6 Ag2 110.55(12) . .
Ag1 I6 I2 71.10(11) 10_557 .
Ag1 I6 I2 71.10(11) . .
Ag2 I6 I2 175.93(12) . .
Ag1 I6 I2 75.17(8) 10_557 2_765
Ag1 I6 I2 75.17(8) . 2_765
Ag2 I6 I2 73.67(11) . 2_765
I2 I6 I2 110.40(10) . 2_765
Ag1 I6 I3 172.63(14) 10_557 .
Ag1 I6 I3 68.48(3) . .
Ag2 I6 I3 63.68(7) . .
I2 I6 I3 114.34(10) . .
I2 I6 I3 106.42(10) 2_765 .
Ag1 I6 I3 68.49(3) 10_557 10_557
Ag1 I6 I3 172.63(14) . 10_557
Ag2 I6 I3 63.68(7) . 10_557
I2 I6 I3 114.34(10) . 10_557
I2 I6 I3 106.42(10) 2_765 10_557
I3 I6 I3 104.28(10) . 10_557
Ag1 I6 Ag2' 114.68(11) 10_557 .
Ag1 I6 Ag2' 114.68(11) . .
Ag2 I6 Ag2' 11.48(5) . .
I2 I6 Ag2' 164.45(12) . .
I2 I6 Ag2' 85.15(12) 2_765 .
I3 I6 Ag2' 58.74(7) . .
I3 I6 Ag2' 58.74(7) 10_557 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
I2 I6 2.727(4) .
I2 I6 2.728(3) 3_675
I2 Ag1 2.8660(10) 10_557
I2 Ag1 2.8661(10) .
I2 Ag1 3.0018(9) 12_677
I2 Ag1 3.0018(9) 3_675
I2 Ag2 3.1893(16) 3_675
I3 I6 2.8261(19) .
I3 Ag1 2.8481(8) .
I3 Ag2 2.8635(13) .
I3 Ag2' 2.8783(18) .
I3 Ag3 2.9430(6) .
I4 Ag2' 2.662(3) 2_655
I4 Ag3 2.7875(13) .
I4 Ag2 2.801(2) 2_655
I1 Ag1 2.8204(10) .
I1 Ag1 2.8204(10) 2_765
I1 Ag1 2.8204(10) 3_675
Ag1 I6 2.1317(17) .
Ag1 I2 3.0019(9) 2_765
Ag1 Ag1 3.0643(12) 2_765
Ag1 Ag1 3.0643(12) 3_675
Ag3 I5 2.8747(12) .
Ag3 I3 2.9430(6) 10_557
Ag3 Ag2' 2.946(2) .
Ag3 I5' 2.9510(13) 10_557
Ag3 I5' 2.9510(13) .
Ag3 Ag2 3.3212(18) .
Ag2 Ag2' 0.714(3) .
Ag2 I6 2.588(5) .
Ag2 I4 2.801(2) 3_665
Ag2 I3 2.8635(13) 10_557
Ag2 I2 3.1893(16) 2_765
Ag2' I4 2.661(3) 3_665
Ag2' I3 2.8783(18) 10_557
Ag2' I6 3.031(5) .
I5 I5' 0.667(3) .
I5 I5' 0.667(3) 10_557
I5 Ag3 2.8747(12) 3_665
I5 Ag3 2.8747(12) 2_655
I5' I5' 1.334(6) 10_557
I5' Ag3 2.9511(13) 3_665
I5' Ag3 2.9511(14) 2_655
Co1 N2 2.109(4) 3_565
Co1 N2 2.109(4) 2_665
Co1 N2 2.109(4) .
Co1 N1 2.150(5) 3_565
Co1 N1 2.150(5) 2_665
Co1 N1 2.150(5) .
N2 C10 1.330(7) .
N2 C11 1.353(8) .
C11 C7 1.417(7) .
C11 C12 1.439(7) .
C12 N1 1.322(6) .
C12 C4 1.417(8) .
C7 C6 1.394(10) .
C7 C8 1.421(9) .
C10 C9 1.402(9) .
C4 C3 1.362(9) .
C4 C5 1.431(8) .
C3 C2 1.416(9) .
C8 C9 1.360(11) .
C6 C5 1.359(10) .
N1 C1 1.329(7) .
C1 C2 1.357(10) .
I6 Ag1 2.1316(17) 10_557
I6 I2 2.728(3) 2_765
I6 I3 2.8261(19) 10_557
