#------------------------------------------------------------------------------
#$Date: 2020-03-05 02:08:00 +0200 (Thu, 05 Mar 2020) $
#$Revision: 248942 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/30/7703043.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_7703043
loop_
_publ_author_name
'Chupina, Anastasia V.'
'Shayapov, Vladimir'
'Novikov, Alexander S.'
'Volchek, Victoria V.'
'Benassi, Enrico'
'Abramov, Pavel A.'
'Sokolov, Maxim N.'
_publ_section_title
;
 [{AgL}₂Mo₈O₂₆]ⁿ⁻ complexes: a
 combined experimental and theoretical study.
;
_journal_issue                   5
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1522
_journal_page_last               1530
_journal_paper_doi               10.1039/c9dt04043a
_journal_volume                  49
_journal_year                    2020
_chemical_formula_sum            'C74 H116 Ag2 As2 Mo8 N4 O28'
_chemical_formula_weight         2642.80
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2017/1
_audit_update_record
;
2019-10-15 deposited with the CCDC.	2019-12-26 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 105.954(3)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   13.7196(4)
_cell_length_b                   15.0038(4)
_cell_length_c                   22.9225(7)
_cell_measurement_reflns_used    9693
_cell_measurement_temperature    130(2)
_cell_measurement_theta_max      29.2510
_cell_measurement_theta_min      3.7680
_cell_volume                     4536.8(2)
_computing_cell_refinement       'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_molecular_graphics    'ShelXle (Hübschle, 2011)'
_computing_publication_material  'CIFTAB-2014 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXS-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      130(2)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 10.6168
_diffrn_detector_type            AtlasS2
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.848
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'New Xcalibur, AtlasS2'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0257
_diffrn_reflns_av_unetI/netI     0.0398
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.848
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            23821
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.848
_diffrn_reflns_theta_full        25.500
_diffrn_reflns_theta_max         29.493
_diffrn_reflns_theta_min         3.376
_diffrn_source                   'sealed X-ray tube'
_exptl_absorpt_coefficient_mu    2.287
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.69225
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.38.41 (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.935
_exptl_crystal_description       plate
_exptl_crystal_F_000             2616
_exptl_crystal_size_max          0.320
_exptl_crystal_size_mid          0.320
_exptl_crystal_size_min          0.060
_refine_diff_density_max         0.761
_refine_diff_density_min         -0.686
_refine_diff_density_rms         0.114
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.058
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     532
_refine_ls_number_reflns         10710
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.058
_refine_ls_R_factor_all          0.0431
_refine_ls_R_factor_gt           0.0295
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0257P)²+1.6793P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0628
_refine_ls_wR_factor_ref         0.0674
_reflns_Friedel_coverage         0.000
_reflns_number_gt                8788
_reflns_number_total             10710
_reflns_threshold_expression     >2σ(I)
_cod_data_source_file            c9dt04043a2.cif
_cod_data_source_block           3
_cod_depositor_comments
'Adding full bibliography for 7703041--7703051.cif.'
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7703043
_shelx_shelxl_version_number     2017/1
_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   0.528
_shelx_estimated_absorpt_t_max   0.875
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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
C1 C 0.9395(3) -0.0195(2) 0.61115(14) 0.0266(7) Uani 1 1 d . .
H1A H 0.870258 -0.019850 0.611172 0.032 Uiso 1 1 calc R U
C2 C 1.0722(2) 0.0490(2) 0.57501(15) 0.0276(8) Uani 1 1 d . .
H2A H 1.079008 0.100135 0.549835 0.041 Uiso 1 1 calc R U
H2B H 1.118703 0.055997 0.615675 0.041 Uiso 1 1 calc R U
H2C H 1.088604 -0.005900 0.556569 0.041 Uiso 1 1 calc R U
C3 C 0.8973(3) 0.1111(2) 0.54691(15) 0.0322(8) Uani 1 1 d . .
H3A H 0.931863 0.152427 0.526150 0.048 Uiso 1 1 calc R U
H3B H 0.841692 0.081595 0.516975 0.048 Uiso 1 1 calc R U
H3C H 0.870012 0.144135 0.575789 0.048 Uiso 1 1 calc R U
C4 C 0.7063(2) 0.42747(19) 0.44822(13) 0.0179(6) Uani 1 1 d . .
C5 C 0.6601(2) 0.4071(2) 0.49331(13) 0.0211(7) Uani 1 1 d . .
H5A H 0.653988 0.346784 0.504359 0.025 Uiso 1 1 calc R U
C6 C 0.6230(3) 0.4747(2) 0.52215(14) 0.0267(7) Uani 1 1 d . .
H6A H 0.592126 0.460698 0.553377 0.032 Uiso 1 1 calc R U
C7 C 0.6305(3) 0.5626(2) 0.50578(14) 0.0268(8) Uani 1 1 d . .
H7A H 0.604198 0.608769 0.525394 0.032 Uiso 1 1 calc R U
C8 C 0.6763(3) 0.5830(2) 0.46103(15) 0.0280(8) Uani 1 1 d . .
H8A H 0.681517 0.643390 0.449767 0.034 Uiso 1 1 calc R U
C9 C 0.7148(3) 0.5156(2) 0.43231(15) 0.0256(7) Uani 1 1 d . .
H9A H 0.747009 0.529933 0.401743 0.031 Uiso 1 1 calc R U
C10 C 0.7617(2) 0.3855(2) 0.33330(13) 0.0196(7) Uani 1 1 d . .
C11 C 0.8506(3) 0.4163(2) 0.32382(14) 0.0229(7) Uani 1 1 d . .
H11A H 0.912919 0.409266 0.354343 0.027 Uiso 1 1 calc R U
C12 C 0.8486(3) 0.4579(2) 0.26905(15) 0.0292(8) Uani 1 1 d . .
H12A H 0.909803 0.478749 0.262079 0.035 Uiso 1 1 calc R U
C13 C 0.7578(3) 0.4688(2) 0.22496(15) 0.0303(8) Uani 1 1 d . .
H13A H 0.756714 0.497474 0.187829 0.036 Uiso 1 1 calc R U
C14 C 0.6689(3) 0.4382(3) 0.23470(15) 0.0331(9) Uani 1 1 d . .
H14A H 0.606389 0.446420 0.204543 0.040 Uiso 1 1 calc R U
C15 C 0.6709(3) 0.3954(2) 0.28871(14) 0.0310(8) Uani 1 1 d . .
H15A H 0.609973 0.372888 0.295085 0.037 Uiso 1 1 calc R U
C16 C 0.8943(2) 0.3146(2) 0.45324(13) 0.0207(7) Uani 1 1 d . .
C17 C 0.9503(2) 0.2488(2) 0.43534(14) 0.0223(7) Uani 1 1 d . .
H17A H 0.920259 0.213040 0.400898 0.027 Uiso 1 1 calc R U
C18 C 1.0503(3) 0.2351(2) 0.46762(15) 0.0294(8) Uani 1 1 d . .
H18A H 1.089305 0.190984 0.454511 0.035 Uiso 1 1 calc R U
C19 C 1.0937(3) 0.2849(2) 0.51869(17) 0.0364(9) Uani 1 1 d . .
H19A H 1.161606 0.273870 0.541630 0.044 Uiso 1 1 calc R U
C20 C 1.0376(3) 0.3507(3) 0.53611(18) 0.0440(10) Uani 1 1 d . .
H20A H 1.067801 0.385773 0.570891 0.053 Uiso 1 1 calc R U
C21 C 0.9378(3) 0.3667(2) 0.50373(15) 0.0330(9) Uani 1 1 d . .
H21A H 0.899901 0.412526 0.515928 0.040 Uiso 1 1 calc R U
C22 C 0.3937(2) 0.60843(18) 0.25488(13) 0.0175(6) Uani 1 1 d . .
H22A H 0.322622 0.598622 0.230832 0.021 Uiso 1 1 calc R U
H22B H 0.437806 0.588953 0.229619 0.021 Uiso 1 1 calc R U
C23 C 0.4146(3) 0.54917(19) 0.31013(13) 0.0215(7) Uani 1 1 d . .
H23A H 0.366095 0.562546 0.333915 0.026 Uiso 1 1 calc R U
H23B H 0.484085 0.559997 0.336278 0.026 Uiso 1 1 calc R U
C24 C 0.4037(2) 0.45231(19) 0.28948(14) 0.0209(7) Uani 1 1 d . .
H24A H 0.451505 0.440147 0.265033 0.025 Uiso 1 1 calc R U
H24B H 0.334082 0.442438 0.263224 0.025 Uiso 1 1 calc R U
C25 C 0.4245(3) 0.3875(2) 0.34267(14) 0.0266(8) Uani 1 1 d . .
H25A H 0.416563 0.326171 0.327285 0.040 Uiso 1 1 calc R U
H25B H 0.493778 0.396096 0.368359 0.040 Uiso 1 1 calc R U
H25C H 0.376365 0.398386 0.366550 0.040 Uiso 1 1 calc R U
C26 C 0.5192(2) 0.7291(2) 0.29873(13) 0.0181(6) Uani 1 1 d . .
H26A H 0.525723 0.794526 0.303708 0.022 Uiso 1 1 calc R U
H26B H 0.534773 0.702759 0.339871 0.022 Uiso 1 1 calc R U
C27 C 0.5982(2) 0.6976(2) 0.26923(15) 0.0275(8) Uani 1 1 d . .
H27A H 0.585824 0.724697 0.228460 0.033 Uiso 1 1 calc R U
H27B H 0.594200 0.632029 0.264383 0.033 Uiso 1 1 calc R U
C28 C 0.7021(3) 0.7236(3) 0.30781(16) 0.0333(8) Uani 1 1 d . .
H28A H 0.705532 0.789371 0.310835 0.040 Uiso 1 1 calc R U
H28B H 0.711062 0.699805 0.349242 0.040 Uiso 1 1 calc R U
C29 C 0.7885(3) 0.6916(3) 0.2851(2) 0.0486(11) Uani 1 1 d . .
H29A H 0.852756 0.711407 0.312793 0.073 Uiso 1 1 calc R U
H29B H 0.787464 0.626334 0.283035 0.073 Uiso 1 1 calc R U
H29C H 0.781922 0.716094 0.244544 0.073 Uiso 1 1 calc R U
C30 C 0.3779(2) 0.74989(19) 0.20301(12) 0.0178(6) Uani 1 1 d . .
H30A H 0.422279 0.725671 0.179298 0.021 Uiso 1 1 calc R U
H30B H 0.307680 0.731021 0.182507 0.021 Uiso 1 1 calc R U
C31 C 0.3825(2) 0.85048(19) 0.20119(13) 0.0205(7) Uani 1 1 d . .
H31A H 0.450765 0.871162 0.224168 0.025 Uiso 1 1 calc R U
H31B H 0.332351 0.876262 0.220305 0.025 Uiso 1 1 calc R U
C32 C 0.3594(2) 0.8815(2) 0.13523(13) 0.0215(7) Uani 1 1 d . .
H32A H 0.409796 0.854984 0.116595 0.026 Uiso 1 1 calc R U
H32B H 0.291641 0.859325 0.112580 0.026 Uiso 1 1 calc R U
C33 C 0.3616(3) 0.9822(2) 0.12900(14) 0.0286(8) Uani 1 1 d . .
H33A H 0.346422 0.998167 0.085974 0.043 Uiso 1 1 calc R U
H33B H 0.310842 1.008899 0.146495 0.043 Uiso 1 1 calc R U
H33C H 0.429057 1.004556 0.150513 0.043 Uiso 1 1 calc R U
C34 C 0.3477(2) 0.7437(2) 0.30668(13) 0.0191(7) Uani 1 1 d . .
H34A H 0.358972 0.808861 0.311076 0.023 Uiso 1 1 calc R U
H34B H 0.373957 0.716898 0.347441 0.023 Uiso 1 1 calc R U
C35 C 0.2344(2) 0.7270(2) 0.28520(14) 0.0230(7) Uani 1 1 d . .
H35A H 0.221582 0.662198 0.279867 0.028 Uiso 1 1 calc R U
H35B H 0.206042 0.756266 0.245419 0.028 Uiso 1 1 calc R U
C36 C 0.1820(3) 0.7632(3) 0.33077(15) 0.0325(8) Uani 1 1 d . .
H36A H 0.212648 0.735739 0.370890 0.039 Uiso 1 1 calc R U
H36B H 0.193104 0.828380 0.334909 0.039 Uiso 1 1 calc R U
C37 C 0.0687(3) 0.7444(3) 0.31176(16) 0.0344(9) Uani 1 1 d . .
H37A H 0.037933 0.768747 0.342220 0.052 Uiso 1 1 calc R U
H37B H 0.037798 0.772547 0.272427 0.052 Uiso 1 1 calc R U
H37C H 0.057337 0.679934 0.308398 0.052 Uiso 1 1 calc R U
N1 N 0.40912(18) 0.70797(15) 0.26622(10) 0.0156(5) Uani 1 1 d . .
N2 N 0.9692(2) 0.04421(17) 0.57937(12) 0.0231(6) Uani 1 1 d . .
O1 O 0.50562(16) 0.13187(13) 0.33066(9) 0.0190(5) Uani 1 1 d . .
O2 O 0.69615(16) 0.04774(13) 0.41315(9) 0.0182(4) Uani 1 1 d . .
O3 O 0.66413(15) 0.15744(12) 0.51836(9) 0.0163(4) Uani 1 1 d . .
O4 O 0.70384(16) -0.13316(13) 0.41877(9) 0.0196(5) Uani 1 1 d . .
O5 O 0.66747(14) -0.03164(12) 0.51631(8) 0.0127(4) Uani 1 1 d . .
O6 O 0.52480(15) -0.04866(12) 0.35280(8) 0.0154(4) Uani 1 1 d . .
O7 O 0.50489(14) 0.04368(12) 0.44838(8) 0.0118(4) Uani 1 1 d . .
O8 O 0.64609(15) 0.05990(12) 0.61644(8) 0.0152(4) Uani 1 1 d . .
O9 O 0.47387(14) 0.13417(12) 0.53919(8) 0.0122(4) Uani 1 1 d . .
O10 O 0.29776(15) 0.22233(13) 0.46495(9) 0.0192(5) Uani 1 1 d . .
O11 O 0.33792(15) 0.11562(13) 0.37419(8) 0.0162(4) Uani 1 1 d . .
O12 O 0.35061(16) 0.02476(13) 0.27015(9) 0.0207(5) Uani 1 1 d . .
O13 O 0.47969(16) 0.23765(13) 0.44004(8) 0.0183(4) Uani 1 1 d . .
O14 O 0.99447(19) -0.07788(16) 0.64044(10) 0.0327(6) Uani 1 1 d . .
As1 As 0.75324(2) 0.32931(2) 0.40799(2) 0.01670(7) Uani 1 1 d . .
Mo1 Mo 0.42715(2) 0.04659(2) 0.34024(2) 0.01345(6) Uani 1 1 d . .
Mo2 Mo 0.39513(2) 0.16161(2) 0.45335(2) 0.01210(6) Uani 1 1 d . .
Mo3 Mo 0.59807(2) 0.07181(2) 0.53777(2) 0.01057(6) Uani 1 1 d . .
Mo4 Mo 0.63103(2) -0.04480(2) 0.42591(2) 0.01234(6) Uani 1 1 d . .
Ag1 Ag 0.63900(2) 0.20038(2) 0.40004(2) 0.02545(7) 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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
As As 0.0499 2.0058 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Mo Mo -1.6832 0.6857 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
O14 C1 N2 125.2(3) . .
O14 C1 H1A 117.4 . .
N2 C1 H1A 117.4 . .
N2 C2 H2A 109.5 . .
N2 C2 H2B 109.5 . .
H2A C2 H2B 109.5 . .
N2 C2 H2C 109.5 . .
H2A C2 H2C 109.5 . .
H2B C2 H2C 109.5 . .
N2 C3 H3A 109.5 . .
N2 C3 H3B 109.5 . .
H3A C3 H3B 109.5 . .
N2 C3 H3C 109.5 . .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
C9 C4 C5 119.7(3) . .
C9 C4 As1 122.5(2) . .
C5 C4 As1 117.8(2) . .
C6 C5 C4 119.9(3) . .
C6 C5 H5A 120.0 . .
C4 C5 H5A 120.0 . .
C5 C6 C7 120.3(3) . .
C5 C6 H6A 119.8 . .
C7 C6 H6A 119.8 . .
C8 C7 C6 119.9(3) . .
C8 C7 H7A 120.1 . .
C6 C7 H7A 120.1 . .
C7 C8 C9 120.1(3) . .
C7 C8 H8A 119.9 . .
C9 C8 H8A 119.9 . .
C4 C9 C8 120.0(3) . .
C4 C9 H9A 120.0 . .
C8 C9 H9A 120.0 . .
C11 C10 C15 120.2(3) . .
C11 C10 As1 123.7(2) . .
C15 C10 As1 116.0(2) . .
C10 C11 C12 119.5(3) . .
C10 C11 H11A 120.2 . .
C12 C11 H11A 120.2 . .
C13 C12 C11 120.2(3) . .
C13 C12 H12A 119.9 . .
C11 C12 H12A 119.9 . .
C14 C13 C12 120.2(3) . .
C14 C13 H13A 119.9 . .
C12 C13 H13A 119.9 . .
C13 C14 C15 119.8(3) . .
C13 C14 H14A 120.1 . .
C15 C14 H14A 120.1 . .
C10 C15 C14 120.1(3) . .
C10 C15 H15A 119.9 . .
C14 C15 H15A 119.9 . .
C17 C16 C21 120.2(3) . .
C17 C16 As1 118.5(2) . .
C21 C16 As1 121.3(3) . .
C16 C17 C18 119.9(3) . .
C16 C17 H17A 120.0 . .
C18 C17 H17A 120.0 . .
C19 C18 C17 120.5(3) . .
C19 C18 H18A 119.8 . .
C17 C18 H18A 119.8 . .
C20 C19 C18 119.3(3) . .
C20 C19 H19A 120.3 . .
C18 C19 H19A 120.3 . .
C19 C20 C21 121.1(3) . .
C19 C20 H20A 119.4 . .
C21 C20 H20A 119.4 . .
C20 C21 C16 119.0(3) . .
C20 C21 H21A 120.5 . .
C16 C21 H21A 120.5 . .
C23 C22 N1 116.7(2) . .
C23 C22 H22A 108.1 . .
N1 C22 H22A 108.1 . .
C23 C22 H22B 108.1 . .
N1 C22 H22B 108.1 . .
H22A C22 H22B 107.3 . .
C22 C23 C24 108.8(2) . .
C22 C23 H23A 109.9 . .
C24 C23 H23A 109.9 . .
C22 C23 H23B 109.9 . .
C24 C23 H23B 109.9 . .
H23A C23 H23B 108.3 . .
C23 C24 C25 112.3(3) . .
C23 C24 H24A 109.1 . .
C25 C24 H24A 109.1 . .
C23 C24 H24B 109.1 . .
C25 C24 H24B 109.1 . .
H24A C24 H24B 107.9 . .
C24 C25 H25A 109.5 . .
C24 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
C24 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
C27 C26 N1 117.1(2) . .
C27 C26 H26A 108.0 . .
N1 C26 H26A 108.0 . .
C27 C26 H26B 108.0 . .
N1 C26 H26B 108.0 . .
H26A C26 H26B 107.3 . .
C26 C27 C28 109.8(3) . .
C26 C27 H27A 109.7 . .
C28 C27 H27A 109.7 . .
C26 C27 H27B 109.7 . .
C28 C27 H27B 109.7 . .
H27A C27 H27B 108.2 . .
C29 C28 C27 115.1(3) . .
C29 C28 H28A 108.5 . .
C27 C28 H28A 108.5 . .
C29 C28 H28B 108.5 . .
C27 C28 H28B 108.5 . .
H28A C28 H28B 107.5 . .
C28 C29 H29A 109.5 . .
C28 C29 H29B 109.5 . .
H29A C29 H29B 109.5 . .
C28 C29 H29C 109.5 . .
H29A C29 H29C 109.5 . .
H29B C29 H29C 109.5 . .
C31 C30 N1 115.7(2) . .
C31 C30 H30A 108.4 . .
N1 C30 H30A 108.4 . .
C31 C30 H30B 108.4 . .
N1 C30 H30B 108.4 . .
H30A C30 H30B 107.4 . .
C30 C31 C32 109.4(2) . .
C30 C31 H31A 109.8 . .
C32 C31 H31A 109.8 . .
C30 C31 H31B 109.8 . .
C32 C31 H31B 109.8 . .
H31A C31 H31B 108.2 . .
C33 C32 C31 113.0(2) . .
C33 C32 H32A 109.0 . .
C31 C32 H32A 109.0 . .
C33 C32 H32B 109.0 . .
C31 C32 H32B 109.0 . .
H32A C32 H32B 107.8 . .
C32 C33 H33A 109.5 . .
C32 C33 H33B 109.5 . .
H33A C33 H33B 109.5 . .
C32 C33 H33C 109.5 . .
H33A C33 H33C 109.5 . .
H33B C33 H33C 109.5 . .
N1 C34 C35 115.9(2) . .
N1 C34 H34A 108.3 . .
C35 C34 H34A 108.3 . .
N1 C34 H34B 108.3 . .
C35 C34 H34B 108.3 . .
H34A C34 H34B 107.4 . .
C34 C35 C36 110.7(2) . .
C34 C35 H35A 109.5 . .
C36 C35 H35A 109.5 . .
C34 C35 H35B 109.5 . .
C36 C35 H35B 109.5 . .
H35A C35 H35B 108.1 . .
C37 C36 C35 112.1(3) . .
C37 C36 H36A 109.2 . .
C35 C36 H36A 109.2 . .
C37 C36 H36B 109.2 . .
C35 C36 H36B 109.2 . .
H36A C36 H36B 107.9 . .
C36 C37 H37A 109.5 . .
C36 C37 H37B 109.5 . .
H37A C37 H37B 109.5 . .
C36 C37 H37C 109.5 . .
H37A C37 H37C 109.5 . .
H37B C37 H37C 109.5 . .
C34 N1 C22 112.2(2) . .
C34 N1 C26 105.7(2) . .
C22 N1 C26 111.2(2) . .
C34 N1 C30 112.1(2) . .
C22 N1 C30 104.6(2) . .
C26 N1 C30 111.1(2) . .
C1 N2 C2 121.7(3) . .
C1 N2 C3 120.5(3) . .
C2 N2 C3 117.8(3) . .
Mo1 O1 Ag1 130.29(10) . .
Mo4 O2 Ag1 128.43(11) . .
Mo3 O5 Mo4 109.78(9) . .
Mo3 O5 Mo2 110.32(9) . 3_656
Mo4 O5 Mo2 102.71(8) . 3_656
Mo4 O6 Mo1 116.34(9) . .
Mo3 O7 Mo3 104.09(7) . 3_656
Mo3 O7 Mo2 91.56(6) . .
Mo3 O7 Mo2 97.70(7) 3_656 .
Mo3 O7 Mo4 92.25(7) . .
Mo3 O7 Mo4 96.97(7) 3_656 .
Mo2 O7 Mo4 163.45(9) . .
Mo3 O7 Mo1 163.60(9) . .
Mo3 O7 Mo1 92.31(6) 3_656 .
Mo2 O7 Mo1 85.87(6) . .
Mo4 O7 Mo1 85.94(6) . .
Mo3 O8 Mo1 115.99(9) . 3_656
Mo3 O9 Mo2 108.58(9) . .
Mo3 O9 Mo4 111.34(8) . 3_656
Mo2 O9 Mo4 104.12(8) . 3_656
Mo2 O11 Mo1 116.15(10) . .
C4 As1 C16 104.16(13) . .
C4 As1 C10 101.38(12) . .
C16 As1 C10 103.22(13) . .
C4 As1 Ag1 110.10(9) . .
C16 As1 Ag1 118.09(9) . .
C10 As1 Ag1 117.83(9) . .
O12 Mo1 O1 105.60(10) . .
O12 Mo1 O11 100.98(9) . .
O1 Mo1 O11 98.11(9) . .
O12 Mo1 O6 102.89(9) . .
O1 Mo1 O6 97.86(9) . .
O11 Mo1 O6 146.41(8) . .
O12 Mo1 O8 92.61(9) . 3_656
O1 Mo1 O8 161.79(8) . 3_656
O11 Mo1 O8 78.08(8) . 3_656
O6 Mo1 O8 77.55(8) . 3_656
O12 Mo1 O7 162.72(9) . .
O1 Mo1 O7 91.67(8) . .
O11 Mo1 O7 75.23(7) . .
O6 Mo1 O7 74.94(7) . .
O8 Mo1 O7 70.13(7) 3_656 .
O10 Mo2 O13 105.73(10) . .
O10 Mo2 O11 102.03(9) . .
O13 Mo2 O11 101.19(9) . .
O10 Mo2 O9 101.02(8) . .
O13 Mo2 O9 95.90(8) . .
O11 Mo2 O9 146.23(8) . .
O10 Mo2 O5 91.84(8) . 3_656
O13 Mo2 O5 160.11(8) . 3_656
O11 Mo2 O5 83.73(7) . 3_656
O9 Mo2 O5 71.17(7) . 3_656
O10 Mo2 O7 162.88(8) . .
O13 Mo2 O7 91.06(8) . .
O11 Mo2 O7 77.39(7) . .
O9 Mo2 O7 73.36(7) . .
O5 Mo2 O7 71.04(7) 3_656 .
O10 Mo2 Mo3 135.97(7) . .
O13 Mo2 Mo3 82.51(7) . .
O11 Mo2 Mo3 119.00(6) . .
O9 Mo2 Mo3 35.11(5) . .
O5 Mo2 Mo3 78.32(5) 3_656 .
O7 Mo2 Mo3 41.63(4) . .
O3 Mo3 O8 105.66(9) . .
O3 Mo3 O9 99.94(9) . .
O8 Mo3 O9 96.60(8) . .
O3 Mo3 O5 101.69(9) . .
O8 Mo3 O5 96.13(8) . .
O9 Mo3 O5 150.84(8) . .
O3 Mo3 O7 96.88(8) . .
O8 Mo3 O7 157.47(8) . .
O9 Mo3 O7 79.39(7) . .
O5 Mo3 O7 78.83(7) . .
O3 Mo3 O7 172.69(8) . 3_656
O8 Mo3 O7 81.56(8) . 3_656
O9 Mo3 O7 77.76(7) . 3_656
O5 Mo3 O7 78.32(7) . 3_656
O7 Mo3 O7 75.91(7) . 3_656
O3 Mo3 Mo2 87.80(6) . .
O8 Mo3 Mo2 132.90(7) . .
O9 Mo3 Mo2 36.31(5) . .
O5 Mo3 Mo2 125.63(5) . .
O7 Mo3 Mo2 46.81(5) . .
O7 Mo3 Mo2 86.33(4) 3_656 .
O4 Mo4 O2 105.52(10) . .
O4 Mo4 O6 102.77(9) . .
O2 Mo4 O6 100.57(9) . .
O4 Mo4 O5 101.01(9) . .
O2 Mo4 O5 95.90(9) . .
O6 Mo4 O5 146.11(8) . .
O4 Mo4 O9 91.13(8) . 3_656
O2 Mo4 O9 161.36(8) . 3_656
O6 Mo4 O9 83.42(8) . 3_656
O5 Mo4 O9 72.28(7) . 3_656
O4 Mo4 O7 162.38(8) . .
O2 Mo4 O7 91.69(8) . .
O6 Mo4 O7 77.13(7) . .
O5 Mo4 O7 72.95(7) . .
O9 Mo4 O7 71.30(7) 3_656 .
O1 Ag1 O2 80.34(7) . .
O1 Ag1 As1 140.14(5) . .
O2 Ag1 As1 123.88(5) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O14 1.228(4) .
C1 N2 1.332(4) .
C1 H1A 0.9500 .
C2 N2 1.446(4) .
C2 H2A 0.9800 .
C2 H2B 0.9800 .
C2 H2C 0.9800 .
C3 N2 1.459(4) .
C3 H3A 0.9800 .
C3 H3B 0.9800 .
C3 H3C 0.9800 .
C4 C9 1.385(4) .
C4 C5 1.387(4) .
C4 As1 1.939(3) .
C5 C6 1.382(4) .
C5 H5A 0.9500 .
C6 C7 1.382(5) .
C6 H6A 0.9500 .
C7 C8 1.376(5) .
C7 H7A 0.9500 .
C8 C9 1.388(4) .
C8 H8A 0.9500 .
C9 H9A 0.9500 .
C10 C11 1.377(4) .
C10 C15 1.384(4) .
C10 As1 1.940(3) .
C11 C12 1.395(4) .
C11 H11A 0.9500 .
C12 C13 1.381(5) .
C12 H12A 0.9500 .
C13 C14 1.378(5) .
C13 H13A 0.9500 .
C14 C15 1.388(5) .
C14 H14A 0.9500 .
C15 H15A 0.9500 .
C16 C17 1.382(4) .
C16 C21 1.388(4) .
C16 As1 1.940(3) .
C17 C18 1.383(4) .
C17 H17A 0.9500 .
C18 C19 1.378(5) .
C18 H18A 0.9500 .
C19 C20 1.377(5) .
C19 H19A 0.9500 .
C20 C21 1.387(5) .
C20 H20A 0.9500 .
C21 H21A 0.9500 .
C22 C23 1.509(4) .
C22 N1 1.521(3) .
C22 H22A 0.9900 .
C22 H22B 0.9900 .
C23 C24 1.523(4) .
C23 H23A 0.9900 .
C23 H23B 0.9900 .
C24 C25 1.524(4) .
C24 H24A 0.9900 .
C24 H24B 0.9900 .
C25 H25A 0.9800 .
C25 H25B 0.9800 .
C25 H25C 0.9800 .
C26 C27 1.503(4) .
C26 N1 1.522(4) .
C26 H26A 0.9900 .
C26 H26B 0.9900 .
C27 C28 1.508(4) .
C27 H27A 0.9900 .
C27 H27B 0.9900 .
C28 C29 1.499(5) .
C28 H28A 0.9900 .
C28 H28B 0.9900 .
C29 H29A 0.9800 .
C29 H29B 0.9800 .
C29 H29C 0.9800 .
C30 C31 1.512(4) .
C30 N1 1.529(3) .
C30 H30A 0.9900 .
C30 H30B 0.9900 .
C31 C32 1.530(4) .
C31 H31A 0.9900 .
C31 H31B 0.9900 .
C32 C33 1.519(4) .
C32 H32A 0.9900 .
C32 H32B 0.9900 .
C33 H33A 0.9800 .
C33 H33B 0.9800 .
C33 H33C 0.9800 .
C34 N1 1.513(4) .
C34 C35 1.516(4) .
C34 H34A 0.9900 .
C34 H34B 0.9900 .
C35 C36 1.522(4) .
C35 H35A 0.9900 .
C35 H35B 0.9900 .
C36 C37 1.521(5) .
C36 H36A 0.9900 .
C36 H36B 0.9900 .
C37 H37A 0.9800 .
C37 H37B 0.9800 .
C37 H37C 0.9800 .
O1 Mo1 1.725(2) .
O1 Ag1 2.310(2) .
O2 Mo4 1.719(2) .
O2 Ag1 2.413(2) .
O3 Mo3 1.7004(19) .
O4 Mo4 1.695(2) .
O5 Mo3 1.9533(18) .
O5 Mo4 2.0033(18) .
O5 Mo2 2.3135(19) 3_656
O6 Mo4 1.8956(19) .
O6 Mo1 1.9257(19) .
O7 Mo3 2.1379(17) .
O7 Mo3 2.3118(19) 3_656
O7 Mo2 2.3465(18) .
O7 Mo4 2.3479(19) .
O7 Mo1 2.4148(17) .
O8 Mo3 1.7508(18) .
O8 Mo1 2.258(2) 3_656
O9 Mo3 1.9520(19) .
O9 Mo2 2.0099(18) .
O9 Mo4 2.2677(19) 3_656
O10 Mo2 1.697(2) .
O11 Mo2 1.8979(18) .
O11 Mo1 1.924(2) .
O12 Mo1 1.6922(19) .
O13 Mo2 1.713(2) .
As1 Ag1 2.4647(4) .
Mo2 Mo3 3.2171(3) .
