#------------------------------------------------------------------------------
#$Date: 2016-09-10 01:22:34 +0200 (Sat 10 de Sep de 2016) $
#$Revision: 186370 $
#$URL: svn://www.crystallography.net/cod/cif/7/04/00/7040069.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_7040069
loop_
_publ_author_name
'Tian, Aixiang'
'Tian, Yan'
'Ning, Yali'
'Hou, Xue'
'Ni, Huaiping'
'Ji, Xuebin'
'Liu, Guocheng'
'Ying, Jun'
_publ_section_title
;
 A series of Keggin-based compounds constructed by conjugate ring-rich
 pyrazine and quinoxaline derivatives.
;
_journal_issue                   35
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              13925
_journal_page_last               13936
_journal_paper_doi               10.1039/c6dt02233b
_journal_volume                  45
_journal_year                    2016
_chemical_formula_moiety         'C60 H42 Ag3 N6, 2(Mo6 O20 P0.5)'
_chemical_formula_sum            'C60 H42 Ag3 Mo12 N6 O40 P'
_chemical_formula_weight         2992.85
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_date             2016-07-05
_audit_creation_method
;
Olex2 1.2-beta
(compiled 2016.02.19 svn.r3266 for OlexSys, GUI svn.r5155)
;
_audit_update_record
;
2016-07-12 deposited with the CCDC.
2016-07-28 downloaded from the CCDC.
;
_cell_angle_alpha                103.422(2)
_cell_angle_beta                 98.057(2)
_cell_angle_gamma                98.163(2)
_cell_formula_units_Z            2
_cell_length_a                   13.1098(10)
_cell_length_b                   13.9600(11)
_cell_length_c                   24.0311(18)
_cell_measurement_reflns_used    2379
_cell_measurement_temperature    293
_cell_measurement_theta_max      21.65
_cell_measurement_theta_min      2.40
_cell_volume                     4165.5(6)
_computing_cell_refinement       'SMART (Bruker, 2001)'
_computing_data_collection       'SMART (Bruker, 2001)'
_computing_data_reduction        'SAINT+ (Bruker, 1999)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_diffrn_ambient_temperature      293.0
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0671
_diffrn_reflns_av_unetI/netI     0.1765
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            31190
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.993
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.343
_diffrn_reflns_theta_min         0.886
_exptl_absorpt_coefficient_mu    2.536
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    2.386
_exptl_crystal_description       block
_exptl_crystal_F_000             2848
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.13
_refine_diff_density_max         1.867
_refine_diff_density_min         -1.818
_refine_diff_density_rms         0.195
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.010
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1138
_refine_ls_number_reflns         20653
_refine_ls_number_restraints     1246
_refine_ls_restrained_S_all      2.911
_refine_ls_R_factor_all          0.1996
_refine_ls_R_factor_gt           0.0758
_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)+(0.0690P)²+4.0009P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1508
_refine_ls_wR_factor_ref         0.2004
_reflns_Friedel_coverage         0.000
_reflns_number_gt                8815
_reflns_number_total             20653
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c6dt02233b2.cif
_cod_data_source_block           compound-3
_cod_depositor_comments
'Adding full bibliography for 7040067--7040071.cif.'
_cod_database_code               7040069
_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   0.734
_shelx_estimated_absorpt_t_min   0.644
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
2. Restrained distances
 O25-Ag2_$1
 2.757 with sigma of 0.02
3. Rigid body (RIGU) restrains
 All non-hydrogen atoms
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
4. Others
 Fixed Sof: O1(0.5) O1'(0.5) O2'(0.5) O2(0.5) O21'(0.5) O21(0.5) O22'(0.5)
 O22(0.5)
5.a Aromatic/amide H refined with riding coordinates:
 C4(H4), C5(H5), C6(H6), C7(H7), C10(H10), C11(H11), C12(H12), C13(H13),
 C14(H14), C16(H16), C17(H17), C18(H18), C19(H19), C20(H20), C24(H24), C25(H25),
  C26(H26), C27(H27), C30(H30), C31(H31), C32(H32), C33(H33), C34(H34),
 C36(H36), C37(H37), C38(H38), C39(H39), C40(H40), C44(H44), C45(H45), C46(H46),
  C47(H47), C50(H50), C51(H51), C52(H52), C53(H53), C54(H54), C56(H56),
 C57(H57), C58(H58), C59(H59), C60(H60)
;
_shelx_shelxl_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
Ag1 Ag 1.43142(9) -0.25496(9) 0.24515(6) 0.0672(4) Uani 1 1 d . U .
Mo1 Mo 0.76406(9) 0.05816(11) 0.43571(5) 0.0550(4) Uani 1 1 d . U .
P1 P 1.0000 0.0000 0.5000 0.0307(10) Uani 1 2 d S TU P
O1 O 1.1178(11) 0.0479(11) 0.5301(6) 0.032(3) Uani 0.5 1 d . U .
O1' O 0.9555(13) 0.0855(14) 0.4779(7) 0.050(3) Uani 0.5 1 d . U .
N1 N 1.3131(8) -0.1675(8) 0.2306(5) 0.046(2) Uani 1 1 d . U .
C1 C 1.2329(10) -0.2143(10) 0.1869(6) 0.047(3) Uani 1 1 d . U .
Mo2 Mo 0.96077(10) 0.25182(9) 0.53085(5) 0.0459(3) Uani 1 1 d . U .
O2' O 0.9920(11) -0.0877(11) 0.4542(6) 0.027(3) Uani 0.5 1 d . U .
O2 O 0.9441(11) -0.0146(12) 0.5506(6) 0.034(3) Uani 0.5 1 d . U .
Ag2 Ag 1.02765(9) 0.00711(9) 0.17315(7) 0.0788(4) Uani 1 1 d D U .
N2 N 1.1491(8) -0.0708(8) 0.2047(5) 0.046(2) Uani 1 1 d . U .
C2 C 1.1465(10) -0.1669(10) 0.1742(6) 0.045(3) Uani 1 1 d . U .
P2 P 0.5000 0.0000 0.0000 0.0412(12) Uani 1 2 d S TU P
Mo3 Mo 0.91575(9) 0.10504(9) 0.63159(4) 0.0389(3) Uani 1 1 d . U .
O3 O 0.6556(7) 0.0845(8) 0.4032(4) 0.067(3) Uani 1 1 d . U .
Ag3 Ag 0.71676(11) 0.36247(11) 0.29069(6) 0.0834(5) Uani 1 1 d . U .
C3 C 1.2339(10) -0.0192(10) 0.2460(6) 0.047(3) Uani 1 1 d . U .
N3 N 0.9309(8) 0.1133(8) 0.2097(4) 0.042(2) Uani 1 1 d . U .
Mo4 Mo 0.75498(9) -0.10709(10) 0.52811(6) 0.0526(3) Uani 1 1 d . U .
O4 O 0.7417(8) -0.2731(8) 0.3383(4) 0.073(3) Uani 1 1 d . U .
C4 C 1.2381(12) 0.0790(11) 0.2768(6) 0.063(4) Uani 1 1 d . U .
H4 H 1.1833 0.1124 0.2691 0.075 Uiso 1 1 calc R . .
N4 N 0.8131(8) 0.2496(8) 0.2578(4) 0.041(2) Uani 1 1 d . U .
Mo5 Mo 1.00612(9) 0.13273(10) 0.39050(5) 0.0474(3) Uani 1 1 d . U .
O5 O 1.0136(8) 0.2017(7) 0.3435(4) 0.063(3) Uani 1 1 d . U .
N5 N 0.6272(8) 0.4797(8) 0.2738(5) 0.045(3) Uani 1 1 d . U .
C5 C 1.3230(13) 0.1258(13) 0.3180(7) 0.074(4) Uani 1 1 d . U .
H5 H 1.3274 0.1927 0.3371 0.089 Uiso 1 1 calc R . .
Mo6 Mo 0.82404(9) -0.18469(9) 0.38783(5) 0.0426(3) Uani 1 1 d . U .
O6 O 0.8847(7) 0.1566(8) 0.6946(4) 0.066(3) Uani 1 1 d . U .
N6 N 0.5203(7) 0.6306(7) 0.2567(5) 0.042(2) Uani 1 1 d . U .
C6 C 1.4038(12) 0.0766(13) 0.3329(7) 0.070(4) Uani 1 1 d . U .
H6 H 1.4606 0.1104 0.3619 0.083 Uiso 1 1 calc R . .
O7 O 0.9368(9) 0.3668(8) 0.5468(5) 0.087(3) Uani 1 1 d . U .
C7 C 1.3998(11) -0.0188(12) 0.3055(7) 0.063(4) Uani 1 1 d . U .
H7 H 1.4532 -0.0515 0.3165 0.075 Uiso 1 1 calc R . .
Mo7 Mo 0.46632(11) 0.25234(9) 0.01164(5) 0.0539(4) Uani 1 1 d . U .
C8 C 1.3160(10) -0.0714(10) 0.2602(6) 0.046(3) Uani 1 1 d . U .
Mo8 Mo 0.51889(12) 0.16609(9) 0.13962(5) 0.0607(4) Uani 1 1 d . U .
O8 O 0.6401(7) -0.1513(8) 0.5414(4) 0.065(3) Uani 1 1 d . U .
Mo9 Mo 0.50954(13) -0.09544(11) 0.12456(5) 0.0740(5) Uani 1 1 d . U .
O9 O 0.9092(7) -0.2647(7) 0.4261(4) 0.057(2) Uani 1 1 d . U .
C9 C 1.2382(11) -0.3165(11) 0.1538(7) 0.061(3) Uani 1 1 d . U .
Mo10 Mo 0.71748(9) 0.00667(9) -0.07238(6) 0.0514(3) Uani 1 1 d . U .
O10 O 1.0705(6) 0.1576(7) 0.6497(4) 0.056(2) Uani 1 1 d . U .
C10 C 1.2071(18) -0.3923(13) 0.1764(10) 0.126(8) Uani 1 1 d . U .
H10 H 1.1817 -0.3804 0.2111 0.151 Uiso 1 1 calc R . .
Mo11 Mo 0.74092(9) -0.05038(10) 0.06494(5) 0.0478(3) Uani 1 1 d . U .
O11 O 0.8220(8) 0.1761(10) 0.4880(4) 0.086(3) Uani 1 1 d . U .
C11 C 1.213(2) -0.4883(16) 0.1475(12) 0.166(12) Uani 1 1 d . U .
H11 H 1.1869 -0.5421 0.1612 0.200 Uiso 1 1 calc R . .
Mo12 Mo 0.71904(9) 0.19713(8) 0.05537(5) 0.0384(3) Uani 1 1 d . U .
O12 O 0.8667(8) 0.0966(9) 0.3874(4) 0.081(3) Uani 1 1 d . U .
C12 C 1.2589(18) -0.5051(15) 0.0979(11) 0.125(8) Uani 1 1 d . U .
H12 H 1.2637 -0.5698 0.0784 0.150 Uiso 1 1 calc R . .
O13 O 0.7581(9) -0.1864(9) 0.4583(4) 0.087(3) Uani 1 1 d . U .
C13 C 1.2958(13) -0.4263(12) 0.0787(8) 0.083(5) Uani 1 1 d . U .
H13 H 1.3302 -0.4362 0.0471 0.099 Uiso 1 1 calc R . .
O14 O 1.1558(8) 0.1612(7) 0.4300(5) 0.078(3) Uani 1 1 d . U .
C14 C 1.2835(11) -0.3309(11) 0.1051(7) 0.061(4) Uani 1 1 d . U .
H14 H 1.3056 -0.2773 0.0902 0.073 Uiso 1 1 calc R . .
O15 O 0.7173(9) -0.0049(9) 0.4873(5) 0.086(3) Uani 1 1 d . U .
C15 C 1.0479(11) -0.2206(10) 0.1358(7) 0.054(3) Uani 1 1 d . U .
O16 O 1.0281(7) 0.0128(8) 0.3504(5) 0.077(3) Uani 1 1 d . U .
C16 C 0.9582(11) -0.2344(10) 0.1607(7) 0.058(3) Uani 1 1 d . U .
H16 H 0.9616 -0.2100 0.2004 0.070 Uiso 1 1 calc R . .
O17 O 1.0031(8) 0.2403(9) 0.4616(4) 0.080(3) Uani 1 1 d . U .
C17 C 0.8652(13) -0.2845(12) 0.1253(8) 0.074(4) Uani 1 1 d . U .
H17 H 0.8054 -0.2949 0.1414 0.089 Uiso 1 1 calc R . .
O18 O 0.9058(7) 0.2010(7) 0.5932(4) 0.058(2) Uani 1 1 d . U .
C18 C 0.8596(14) -0.3184(13) 0.0681(9) 0.084(5) Uani 1 1 d . U .
H18 H 0.7959 -0.3506 0.0444 0.101 Uiso 1 1 calc R . .
O19 O 0.7980(7) 0.0181(7) 0.5929(5) 0.070(3) Uani 1 1 d . U .
C19 C 0.9489(14) -0.3055(14) 0.0444(8) 0.090(5) Uani 1 1 d . U .
H19 H 0.9453 -0.3310 0.0047 0.109 Uiso 1 1 calc R . .
O20 O 0.7677(9) -0.0739(9) 0.3858(4) 0.085(3) Uani 1 1 d . U .
C20 C 1.0436(13) -0.2553(13) 0.0788(7) 0.075(4) Uani 1 1 d . U .
H20 H 1.1032 -0.2458 0.0624 0.090 Uiso 1 1 calc R . .
C21 C 0.9602(10) 0.2090(9) 0.2142(5) 0.043(3) Uani 1 1 d . U .
O21' O 0.4392(12) 0.0741(12) -0.0288(6) 0.040(3) Uani 0.5 1 d . U .
O21 O 0.4545(12) 0.0171(12) 0.0604(7) 0.044(3) Uani 0.5 1 d . U .
C22 C 0.9006(11) 0.2820(10) 0.2395(5) 0.047(3) Uani 1 1 d . U .
O22' O 0.4519(11) -0.1038(11) -0.0339(6) 0.033(3) Uani 0.5 1 d . U .
O22 O 0.6069(13) 0.0324(12) 0.0113(6) 0.037(3) Uani 0.5 1 d . U .
O23 O 0.4564(8) 0.3695(7) 0.0139(4) 0.067(3) Uani 1 1 d . U .
C23 C 0.7850(10) 0.1504(10) 0.2550(5) 0.042(2) Uani 1 1 d . U .
C24 C 0.6946(11) 0.1102(11) 0.2765(5) 0.051(3) Uani 1 1 d . U .
H24 H 0.6499 0.1525 0.2903 0.061 Uiso 1 1 calc R . .
O24 O 0.8537(8) -0.0748(7) 0.0924(4) 0.077(3) Uani 1 1 d . U .
C25 C 0.6739(12) 0.0150(11) 0.2770(6) 0.060(3) Uani 1 1 d . U .
H25 H 0.6157 -0.0084 0.2914 0.071 Uiso 1 1 calc R . .
O25 O 0.8053(10) 0.0152(7) -0.1067(5) 0.084(3) Uani 1 1 d D U .
C26 C 0.7392(11) -0.0510(11) 0.2559(6) 0.057(3) Uani 1 1 d . U .
H26 H 0.7244 -0.1175 0.2572 0.068 Uiso 1 1 calc R . .
O26 O 0.8228(9) 0.2868(9) 0.0835(5) 0.096(4) Uani 1 1 d . U .
C27 C 0.8238(11) -0.0196(10) 0.2335(5) 0.052(3) Uani 1 1 d . U .
H27 H 0.8663 -0.0644 0.2198 0.062 Uiso 1 1 calc R . .
O27 O 0.5225(7) 0.2439(8) 0.2037(4) 0.062(3) Uani 1 1 d . U .
O28 O 0.5187(6) -0.1368(6) 0.1846(3) 0.040(2) Uani 1 1 d . U .
C28 C 0.8472(10) 0.0823(9) 0.2311(5) 0.040(2) Uani 1 1 d . U .
C29 C 1.0560(12) 0.2377(10) 0.1933(8) 0.062(3) Uani 1 1 d . U .
O29 O 0.6202(8) 0.2625(8) 0.0285(4) 0.066(2) Uani 1 1 d . U .
C30 C 1.1452(13) 0.2942(13) 0.2329(9) 0.088(5) Uani 1 1 d . U .
H30 H 1.1394 0.3173 0.2716 0.106 Uiso 1 1 calc R . .
O30 O 0.4985(10) 0.2079(9) -0.0684(4) 0.102(4) Uani 1 1 d . U .
O31 O 0.7637(7) -0.0462(7) -0.0141(4) 0.053(2) Uani 1 1 d . U .
C31 C 1.2392(17) 0.3164(18) 0.2174(12) 0.131(8) Uani 1 1 d . U .
H31 H 1.2960 0.3558 0.2446 0.157 Uiso 1 1 calc R . .
O32 O 0.5392(9) 0.0510(8) 0.1592(5) 0.102(3) Uani 1 1 d . U .
C32 C 1.2487(18) 0.2809(15) 0.1627(12) 0.113(6) Uani 1 1 d . U .
H32 H 1.3142 0.2933 0.1525 0.136 Uiso 1 1 calc R . .
O33 O 0.7496(7) 0.1396(7) -0.0139(4) 0.052(2) Uani 1 1 d . U .
C33 C 1.1648(18) 0.2258(16) 0.1198(11) 0.115(6) Uani 1 1 d . U .
H33 H 1.1730 0.2034 0.0814 0.138 Uiso 1 1 calc R . .
C34 C 1.0680(14) 0.2054(12) 0.1363(8) 0.079(4) Uani 1 1 d . U .
H34 H 1.0105 0.1694 0.1084 0.095 Uiso 1 1 calc R . .
O34 O 0.3342(9) 0.1854(9) -0.0190(4) 0.098(3) Uani 1 1 d . U .
C35 C 0.9285(10) 0.3903(10) 0.2462(6) 0.050(3) Uani 1 1 d . U .
O35 O 0.6494(8) 0.2035(8) 0.1239(4) 0.070(2) Uani 1 1 d . U .
C36 C 0.9309(13) 0.4533(12) 0.3000(7) 0.073(4) Uani 1 1 d . U .
H36 H 0.9209 0.4280 0.3318 0.088 Uiso 1 1 calc R . .
O36 O 0.6611(9) -0.0656(9) 0.1180(4) 0.099(3) Uani 1 1 d . U .
O37 O 0.7681(7) 0.0864(7) 0.0843(4) 0.054(2) Uani 1 1 d . U .
C37 C 0.9486(19) 0.5555(14) 0.3052(9) 0.119(8) Uani 1 1 d . U .
H37 H 0.9540 0.5987 0.3418 0.143 Uiso 1 1 calc R . .
O38 O 0.3647(9) 0.1021(8) 0.1188(5) 0.101(3) Uani 1 1 d . U .
C38 C 0.9583(19) 0.5945(14) 0.2608(9) 0.121(8) Uani 1 1 d . U .
H38 H 0.9670 0.6634 0.2658 0.145 Uiso 1 1 calc R . .
O39 O 0.4662(8) 0.2452(7) 0.0855(4) 0.064(2) Uani 1 1 d . U .
C39 C 0.9554(16) 0.5315(11) 0.2071(8) 0.100(6) Uani 1 1 d . U .
H39 H 0.9620 0.5580 0.1754 0.120 Uiso 1 1 calc R . .
C40 C 0.9428(12) 0.4302(10) 0.2000(6) 0.063(4) Uani 1 1 d . U .
H40 H 0.9439 0.3883 0.1639 0.076 Uiso 1 1 calc R . .
O40 O 0.3708(10) -0.0856(8) 0.1119(6) 0.119(4) Uani 1 1 d . U .
C41 C 0.5793(10) 0.5248(10) 0.3153(6) 0.045(3) Uani 1 1 d . U .
C42 C 0.5244(9) 0.6033(9) 0.3048(6) 0.041(3) Uani 1 1 d . U .
C43 C 0.5702(9) 0.5856(9) 0.2139(6) 0.039(3) Uani 1 1 d . U .
C44 C 0.5655(11) 0.6112(11) 0.1602(6) 0.056(4) Uani 1 1 d . U .
H44 H 0.5306 0.6622 0.1538 0.067 Uiso 1 1 calc R . .
C45 C 0.6105(11) 0.5630(10) 0.1189(6) 0.054(3) Uani 1 1 d . U .
H45 H 0.6058 0.5801 0.0836 0.065 Uiso 1 1 calc R . .
C46 C 0.6651(11) 0.4871(11) 0.1274(6) 0.057(4) Uani 1 1 d . U .
H46 H 0.6975 0.4555 0.0980 0.068 Uiso 1 1 calc R . .
C47 C 0.6715(11) 0.4586(10) 0.1782(6) 0.052(3) Uani 1 1 d . U .
H47 H 0.7077 0.4077 0.1834 0.063 Uiso 1 1 calc R . .
C48 C 0.6230(9) 0.5069(9) 0.2226(6) 0.038(3) Uani 1 1 d . U .
C49 C 0.5835(12) 0.4901(12) 0.3689(7) 0.062(3) Uani 1 1 d . U .
C50 C 0.5437(16) 0.3921(14) 0.3672(8) 0.095(6) Uani 1 1 d . U .
H50 H 0.5131 0.3471 0.3318 0.114 Uiso 1 1 calc R . .
C51 C 0.549(2) 0.3607(18) 0.4176(10) 0.146(10) Uani 1 1 d . U .
H51 H 0.5213 0.2952 0.4168 0.176 Uiso 1 1 calc R . .
C52 C 0.595(2) 0.4260(19) 0.4672(11) 0.170(12) Uani 1 1 d . U .
H52 H 0.5992 0.4036 0.5009 0.204 Uiso 1 1 calc R . .
C53 C 0.636(2) 0.5221(19) 0.4725(10) 0.171(12) Uani 1 1 d . U .
H53 H 0.6683 0.5646 0.5083 0.205 Uiso 1 1 calc R . .
C54 C 0.6270(18) 0.5548(15) 0.4230(8) 0.119(8) Uani 1 1 d . U .
H54 H 0.6509 0.6219 0.4255 0.143 Uiso 1 1 calc R . .
C55 C 0.4663(11) 0.6547(12) 0.3487(6) 0.055(3) Uani 1 1 d . U .
C56 C 0.5008(13) 0.7574(13) 0.3748(8) 0.086(5) Uani 1 1 d . U .
H56 H 0.5626 0.7892 0.3672 0.103 Uiso 1 1 calc R . .
C57 C 0.4439(15) 0.8148(17) 0.4128(8) 0.102(6) Uani 1 1 d . U .
H57 H 0.4662 0.8825 0.4310 0.122 Uiso 1 1 calc R . .
C58 C 0.3498(17) 0.7580(19) 0.4199(9) 0.109(6) Uani 1 1 d . U .
H58 H 0.3121 0.7881 0.4469 0.131 Uiso 1 1 calc R . .
C59 C 0.3152(18) 0.669(2) 0.3912(11) 0.143(10) Uani 1 1 d . U .
H59 H 0.2473 0.6401 0.3925 0.171 Uiso 1 1 calc R . .
C60 C 0.3742(15) 0.6097(16) 0.3570(10) 0.124(8) Uani 1 1 d . U .
H60 H 0.3500 0.5416 0.3408 0.149 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'
Ag Ag -0.8971 1.1015 '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'
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'
P P 0.1023 0.0942 '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
N1 Ag1 N6 167.1(4) . 1_645
O1 Mo1 O1' 45.4(5) 2_756 .
O3 Mo1 O1 157.2(5) . 2_756
O3 Mo1 O1' 156.6(6) . .
O3 Mo1 O11 102.3(5) . .
O3 Mo1 O12 101.5(5) . .
O3 Mo1 O15 102.6(5) . .
O3 Mo1 O20 101.5(5) . .
O11 Mo1 O1 98.6(5) . 2_756
O11 Mo1 O1' 62.1(5) . .
O11 Mo1 O12 86.0(5) . .
O11 Mo1 O20 154.2(5) . .
O12 Mo1 O1 88.9(5) . 2_756
O12 Mo1 O1' 62.2(5) . .
O15 Mo1 O1 65.8(5) . 2_756
O15 Mo1 O1' 96.6(5) . .
O15 Mo1 O11 96.4(5) . .
O15 Mo1 O12 154.7(5) . .
O15 Mo1 O20 88.0(5) . .
O20 Mo1 O1 60.0(5) . 2_756
O20 Mo1 O1' 92.2(5) . .
O20 Mo1 O12 79.7(5) . .
O1 P1 O1 180.0 2_756 .
O1' P1 O1 104.9(8) . .
O1' P1 O1 75.1(8) . 2_756
O1' P1 O1 104.9(8) 2_756 2_756
O1' P1 O1 75.1(8) 2_756 .
O1' P1 O1' 180.0 2_756 .
O2' P1 O1 112.7(7) . .
O2' P1 O1 112.7(7) 2_756 2_756
O2' P1 O1 67.3(7) 2_756 .
O2' P1 O1 67.3(7) . 2_756
O2' P1 O1' 112.2(8) 2_756 2_756
O2' P1 O1' 112.2(8) . .
O2' P1 O1' 67.8(8) . 2_756
O2' P1 O1' 67.8(8) 2_756 .
O2' P1 O2' 180.0(11) 2_756 .
O2' P1 O2 64.5(8) 2_756 .
O2' P1 O2 64.5(8) . 2_756
O2' P1 O2 115.5(8) . .
O2' P1 O2 115.5(8) 2_756 2_756
O2 P1 O1 75.4(7) . 2_756
O2 P1 O1 75.4(7) 2_756 .
O2 P1 O1 104.6(7) 2_756 2_756
O2 P1 O1 104.6(7) . .
O2 P1 O1' 106.2(8) . .
O2 P1 O1' 106.2(8) 2_756 2_756
O2 P1 O1' 73.8(8) . 2_756
O2 P1 O1' 73.8(8) 2_756 .
O2 P1 O2 180.0 . 2_756
Mo1 O1 Mo4 91.4(5) 2_756 2_756
P1 O1 Mo1 119.9(8) . 2_756
P1 O1 O2' 51.7(6) . 2_756
P1 O1 Mo4 120.1(7) . 2_756
P1 O1 Mo6 127.2(7) . 2_756
O2' O1 Mo1 137.6(9) 2_756 2_756
O2' O1 Mo4 130.2(9) 2_756 2_756
O2' O1 Mo6 75.7(7) 2_756 2_756
Mo6 O1 Mo1 94.8(5) 2_756 2_756
Mo6 O1 Mo4 95.1(5) 2_756 2_756
P1 O1' Mo1 119.0(10) . .
P1 O1' Mo2 128.0(9) . .
P1 O1' O2' 52.1(7) . 2_756
P1 O1' Mo5 120.8(9) . .
Mo2 O1' Mo1 93.9(6) . .
Mo2 O1' Mo5 94.7(6) . .
O2' O1' Mo1 126.9(10) 2_756 .
O2' O1' Mo2 76.2(8) 2_756 .
O2' O1' Mo5 140.3(11) 2_756 .
Mo5 O1' Mo1 91.8(5) . .
C1 N1 Ag1 114.6(8) . .
C1 N1 C8 120.0(10) . .
C8 N1 Ag1 125.4(9) . .
N1 C1 C2 120.6(12) . .
N1 C1 C9 117.2(11) . .
C2 C1 C9 122.1(13) . .
O7 Mo2 O1' 159.9(6) . .
O7 Mo2 O9 103.0(5) . 2_756
O7 Mo2 O11 101.0(6) . .
O7 Mo2 O17 103.1(6) . .
O7 Mo2 O18 100.5(5) . .
O9 Mo2 O1' 94.8(5) 2_756 .
O9 Mo2 O11 154.0(5) 2_756 .
O9 Mo2 O18 86.2(4) 2_756 .
O11 Mo2 O1' 63.5(5) . .
O11 Mo2 O18 79.7(4) . .
O17 Mo2 O1' 65.5(6) . .
O17 Mo2 O9 96.2(4) . 2_756
O17 Mo2 O11 88.0(4) . .
O17 Mo2 O18 155.1(5) . .
O18 Mo2 O1' 89.6(5) . .
P1 O2' O1 61.0(7) . 2_756
P1 O2' O1' 60.1(8) . 2_756
P1 O2' O2 61.4(8) . 2_756
P1 O2' Mo3 127.0(8) . 2_756
O1 O2' Mo3 135.3(8) 2_756 2_756
O1' O2' O1 96.7(10) 2_756 2_756
O1' O2' Mo3 126.4(9) 2_756 2_756
O2 O2' O1 98.8(11) 2_756 2_756
O2 O2' O1' 99.3(11) 2_756 2_756
O2 O2' Mo3 66.0(7) 2_756 2_756
P1 O2 O2' 54.1(7) . 2_756
P1 O2 Mo3 130.0(9) . .
P1 O2 Mo5 121.1(7) . 2_756
O2' O2 Mo3 76.2(8) 2_756 .
O2' O2 Mo5 130.4(9) 2_756 2_756
Mo3 O2 Mo5 93.8(5) . 2_756
N3 Ag2 N2 138.2(4) . .
C2 N2 Ag2 117.1(9) . .
C2 N2 C3 121.2(10) . .
C3 N2 Ag2 120.6(8) . .
C1 C2 C15 123.0(12) . .
N2 C2 C1 118.9(13) . .
N2 C2 C15 117.5(11) . .
O21' P2 O21' 180.0 2_655 .
O21' P2 O21 98.2(7) 2_655 2_655
O21' P2 O21 81.8(7) 2_655 .
O21' P2 O21 81.8(7) . 2_655
O21' P2 O21 98.2(7) . .
O21 P2 O21 180.0 . 2_655
O22' P2 O21' 106.8(8) 2_655 2_655
O22' P2 O21' 73.2(8) 2_655 .
O22' P2 O21' 106.8(8) . .
O22' P2 O21' 73.2(8) . 2_655
O22' P2 O21 105.9(8) . .
O22' P2 O21 74.1(8) . 2_655
O22' P2 O21 105.9(8) 2_655 2_655
O22' P2 O21 74.1(8) 2_655 .
O22' P2 O22' 180.0 . 2_655
O22 P2 O21' 68.4(8) . 2_655
O22 P2 O21' 68.4(8) 2_655 .
O22 P2 O21' 111.6(8) . .
O22 P2 O21' 111.6(8) 2_655 2_655
O22 P2 O21 110.2(8) . .
O22 P2 O21 110.2(8) 2_655 2_655
O22 P2 O21 69.8(8) 2_655 .
O22 P2 O21 69.8(8) . 2_655
O22 P2 O22' 121.5(8) . .
O22 P2 O22' 58.5(8) 2_655 .
O22 P2 O22' 121.5(8) 2_655 2_655
O22 P2 O22' 58.5(8) . 2_655
O22 P2 O22 180.0 . 2_655
O2 Mo3 O2' 37.8(5) . 2_756
O6 Mo3 O2' 158.8(5) . 2_756
O6 Mo3 O2 162.0(5) . .
O6 Mo3 O10 99.4(4) . .
O6 Mo3 O16 100.9(5) . 2_756
O6 Mo3 O18 102.2(5) . .
O6 Mo3 O19 103.8(5) . .
O10 Mo3 O2' 64.0(4) . 2_756
O10 Mo3 O2 88.1(4) . .
O16 Mo3 O2' 89.1(5) 2_756 2_756
O16 Mo3 O2 64.4(5) 2_756 .
O16 Mo3 O10 78.6(4) 2_756 .
O18 Mo3 O2' 65.3(4) . 2_756
O18 Mo3 O2 94.5(5) . .
O18 Mo3 O10 86.3(4) . .
O18 Mo3 O16 154.1(4) . 2_756
O18 Mo3 O19 98.5(4) . .
O19 Mo3 O2' 95.3(5) . 2_756
O19 Mo3 O2 66.8(5) . .
O19 Mo3 O10 154.7(4) . .
O19 Mo3 O16 87.2(4) . 2_756
N5 Ag3 N4 148.0(4) . .
N2 C3 C4 121.7(12) . .
N2 C3 C8 118.2(12) . .
C4 C3 C8 119.9(14) . .
C21 N3 Ag2 119.3(9) . .
C21 N3 C28 119.9(11) . .
C28 N3 Ag2 120.6(8) . .
O8 Mo4 O1 156.8(5) . 2_756
O8 Mo4 O13 102.9(5) . .
O8 Mo4 O14 103.2(5) . 2_756
O8 Mo4 O15 100.9(5) . .
O8 Mo4 O19 100.7(5) . .
O13 Mo4 O1 61.7(5) . 2_756
O13 Mo4 O14 96.8(5) . 2_756
O13 Mo4 O15 87.6(5) . .
O13 Mo4 O19 154.6(5) . .
O14 Mo4 O1 96.2(5) 2_756 2_756
O14 Mo4 O15 153.9(5) 2_756 .
O14 Mo4 O19 86.7(4) 2_756 .
O15 Mo4 O1 63.3(4) . 2_756
O15 Mo4 O19 78.9(5) . .
O19 Mo4 O1 93.0(5) . 2_756
C5 C4 C3 119.2(14) . .
C22 N4 Ag3 117.6(8) . .
C22 N4 C23 120.0(11) . .
C23 N4 Ag3 122.4(9) . .
O1' Mo5 O2 43.9(5) . 2_756
O5 Mo5 O1' 155.9(5) . .
O5 Mo5 O2 158.8(5) . 2_756
O5 Mo5 O12 104.1(5) . .
O5 Mo5 O14 100.2(5) . .
O5 Mo5 O16 103.1(5) . .
O5 Mo5 O17 99.0(5) . .
O12 Mo5 O1' 64.6(5) . .
O12 Mo5 O2 94.3(5) . 2_756
O12 Mo5 O14 153.3(5) . .
O12 Mo5 O17 86.3(4) . .
O14 Mo5 O1' 88.7(5) . .
O14 Mo5 O2 64.6(5) . 2_756
O14 Mo5 O17 78.9(4) . .
O16 Mo5 O1' 99.6(6) . .
O16 Mo5 O2 63.6(5) . 2_756
O16 Mo5 O12 97.2(5) . .
O16 Mo5 O14 88.1(4) . .
O16 Mo5 O17 156.0(5) . .
O17 Mo5 O1' 60.4(5) . .
O17 Mo5 O2 92.5(5) . 2_756
C41 N5 Ag3 118.6(8) . .
C41 N5 C48 120.5(10) . .
C48 N5 Ag3 120.9(8) . .
C4 C5 C6 122.0(16) . .
O4 Mo6 O1 158.3(5) . 2_756
O4 Mo6 O9 101.0(5) . .
O4 Mo6 O10 102.6(5) . 2_756
O4 Mo6 O13 100.8(5) . .
O4 Mo6 O20 102.9(6) . .
O9 Mo6 O1 89.4(4) . 2_756
O9 Mo6 O13 78.7(4) . .
O10 Mo6 O1 96.5(5) 2_756 2_756
O10 Mo6 O9 88.4(4) 2_756 .
O10 Mo6 O13 155.0(5) 2_756 .
O10 Mo6 O20 97.3(5) 2_756 .
O13 Mo6 O1 62.4(5) . 2_756
O20 Mo6 O1 64.3(5) . 2_756
O20 Mo6 O9 153.6(5) . .
O20 Mo6 O13 85.8(4) . .
C42 N6 Ag1 118.5(8) . 1_465
C42 N6 C43 120.2(10) . .
C43 N6 Ag1 121.3(8) . 1_465
C7 C6 C5 119.9(16) . .
C6 C7 C8 121.4(14) . .
O23 Mo7 O21' 157.1(5) . .
O23 Mo7 O29 101.3(4) . .
O23 Mo7 O30 100.2(5) . .
O23 Mo7 O34 102.9(6) . .
O23 Mo7 O39 103.8(5) . .
O29 Mo7 O21' 92.2(5) . .
O29 Mo7 O30 78.4(5) . .
O30 Mo7 O21' 64.3(5) . .
O34 Mo7 O21' 61.3(6) . .
O34 Mo7 O29 153.4(5) . .
O34 Mo7 O30 86.5(5) . .
O39 Mo7 O21' 95.2(5) . .
O39 Mo7 O29 87.1(4) . .
O39 Mo7 O30 154.0(5) . .
O39 Mo7 O34 97.7(5) . .
N1 C8 C3 120.7(13) . .
N1 C8 C7 121.9(12) . .
C7 C8 C3 117.4(13) . .
O27 Mo8 O21 156.1(5) . .
O27 Mo8 O32 102.3(5) . .
O27 Mo8 O35 102.5(4) . .
O27 Mo8 O38 100.8(5) . .
O27 Mo8 O39 101.2(4) . .
O32 Mo8 O21 66.7(5) . .
O32 Mo8 O35 98.4(5) . .
O32 Mo8 O38 85.4(5) . .
O32 Mo8 O39 154.1(4) . .
O35 Mo8 O21 100.2(5) . .
O35 Mo8 O38 154.9(5) . .
O35 Mo8 O39 86.9(4) . .
O38 Mo8 O21 58.5(5) . .
O39 Mo8 O21 87.5(4) . .
O39 Mo8 O38 79.6(4) . .
O28 Mo9 O30 102.5(5) . 2_655
O28 Mo9 O32 100.4(4) . .
O28 Mo9 O36 100.9(4) . .
O28 Mo9 O40 101.4(5) . .
O30 Mo9 O32 155.2(5) 2_655 .
O30 Mo9 O36 86.1(5) 2_655 .
O30 Mo9 O40 97.6(6) 2_655 .
O32 Mo9 O36 80.4(5) . .
O40 Mo9 O32 87.0(5) . .
O40 Mo9 O36 156.1(5) . .
Mo2 O9 Mo6 139.7(5) 2_756 .
C10 C9 C1 117.4(15) . .
C10 C9 C14 121.6(15) . .
C14 C9 C1 120.7(14) . .
O25 Mo10 O21 155.1(6) . 2_655
O25 Mo10 O31 106.4(5) . .
O25 Mo10 O33 101.9(5) . .
O25 Mo10 O38 99.5(6) . 2_655
O25 Mo10 O40 96.1(6) . 2_655
O31 Mo10 O21 94.8(5) . 2_655
O31 Mo10 O33 87.2(4) . .
O31 Mo10 O40 155.4(5) . 2_655
O33 Mo10 O21 91.7(5) . 2_655
O38 Mo10 O21 64.0(6) 2_655 2_655
O38 Mo10 O31 98.4(5) 2_655 .
O38 Mo10 O33 155.4(5) 2_655 .
O38 Mo10 O40 87.1(5) 2_655 2_655
O40 Mo10 O21 66.0(6) 2_655 2_655
O40 Mo10 O33 78.5(4) 2_655 .
Mo6 O10 Mo3 139.1(5) 2_756 .
C9 C10 C11 119(2) . .
O24 Mo11 O21' 159.3(6) . 2_655
O24 Mo11 O31 101.0(5) . .
O24 Mo11 O34 101.9(5) . 2_655
O24 Mo11 O36 103.2(6) . .
O24 Mo11 O37 101.2(4) . .
O31 Mo11 O21' 87.1(4) . 2_655
O31 Mo11 O34 79.0(4) . 2_655
O34 Mo11 O21' 60.7(6) 2_655 2_655
O36 Mo11 O21' 66.7(5) . 2_655
O36 Mo11 O31 153.8(5) . .
O36 Mo11 O34 86.3(5) . 2_655
O36 Mo11 O37 97.5(5) . .
O37 Mo11 O21' 98.1(5) . 2_655
O37 Mo11 O31 87.4(4) . .
O37 Mo11 O34 155.0(5) . 2_655
Mo1 O11 Mo2 140.0(6) . .
C10 C11 C12 120(2) . .
O22' Mo12 O22 33.9(5) 2_655 .
O26 Mo12 O22' 162.7(6) . 2_655
O26 Mo12 O22 162.4(6) . .
O26 Mo12 O29 103.7(5) . .
O26 Mo12 O33 101.9(5) . .
O26 Mo12 O35 100.4(5) . .
O26 Mo12 O37 99.8(5) . .
O29 Mo12 O22' 66.3(5) . 2_655
O29 Mo12 O22 92.4(5) . .
O29 Mo12 O35 86.6(4) . .
O29 Mo12 O37 154.4(4) . .
O33 Mo12 O22' 93.7(5) . 2_655
O33 Mo12 O22 68.6(5) . .
O33 Mo12 O29 97.2(4) . .
O33 Mo12 O35 155.8(4) . .
O33 Mo12 O37 87.7(4) . .
O35 Mo12 O22' 65.9(5) . 2_655
O35 Mo12 O22 87.5(5) . .
O35 Mo12 O37 79.3(4) . .
O37 Mo12 O22' 88.4(4) . 2_655
O37 Mo12 O22 66.0(4) . .
Mo5 O12 Mo1 141.3(6) . .
C13 C12 C11 119(2) . .
Mo4 O13 Mo6 140.4(7) . .
C12 C13 C14 121.1(19) . .
Mo4 O14 Mo5 139.7(6) 2_756 .
C9 C14 C13 118.8(16) . .
Mo1 O15 Mo4 139.2(6) . .
C16 C15 C2 118.2(14) . .
C20 C15 C2 121.0(14) . .
C20 C15 C16 120.8(15) . .
Mo5 O16 Mo3 137.4(6) . 2_756
C17 C16 C15 118.9(16) . .
Mo2 O17 Mo5 138.8(7) . .
C18 C17 C16 120.9(18) . .
Mo3 O18 Mo2 141.6(5) . .
C17 C18 C19 119.5(18) . .
Mo3 O19 Mo4 139.1(6) . .
C18 C19 C20 121.1(19) . .
Mo6 O20 Mo1 140.4(6) . .
C15 C20 C19 118.8(17) . .
N3 C21 C22 121.2(13) . .
N3 C21 C29 116.7(11) . .
C22 C21 C29 122.1(12) . .
P2 O21' Mo7 123.8(8) . .
P2 O21' Mo11 127.1(9) . 2_655
P2 O21' O22 49.2(7) . 2_655
Mo11 O21' Mo7 97.3(6) 2_655 .
O22 O21' Mo7 138.8(9) 2_655 .
O22 O21' Mo11 78.0(8) 2_655 2_655
P2 O21 Mo8 122.0(8) . .
P2 O21 Mo10 128.2(8) . 2_655
P2 O21 O22 48.4(7) . 2_655
Mo10 O21 Mo8 97.9(6) 2_655 .
O22 O21 Mo8 147.1(10) 2_655 .
O22 O21 Mo10 80.0(8) 2_655 2_655
N4 C22 C21 118.6(12) . .
N4 C22 C35 117.0(11) . .
C21 C22 C35 124.4(13) . .
P2 O22' Mo12 133.9(8) . 2_655
O22 O22' P2 56.9(9) 2_655 .
O22 O22' Mo12 77.3(9) 2_655 2_655
P2 O22 Mo12 133.1(9) . .
P2 O22 O21' 62.4(8) . 2_655
P2 O22 O21 61.8(8) . 2_655
P2 O22 O22' 64.6(9) . 2_655
O21' O22 Mo12 140.5(9) 2_655 .
O21' O22 O21 91.3(10) 2_655 2_655
O21 O22 Mo12 128.2(9) 2_655 .
O22' O22 Mo12 68.8(9) 2_655 .
O22' O22 O21' 106.7(12) 2_655 2_655
O22' O22 O21 104.4(12) 2_655 2_655
N4 C23 C24 123.4(12) . .
N4 C23 C28 119.3(12) . .
C28 C23 C24 117.3(13) . .
C25 C24 C23 121.8(14) . .
C24 C25 C26 120.4(15) . .
C27 C26 C25 121.3(15) . .
C26 C27 C28 119.8(13) . .
N3 C28 C23 120.9(12) . .
N3 C28 C27 119.8(12) . .
C23 C28 C27 119.2(13) . .
C30 C29 C21 119.9(16) . .
C34 C29 C21 123.4(16) . .
C34 C29 C30 116.5(16) . .
Mo12 O29 Mo7 140.8(6) . .
C31 C30 C29 123(2) . .
Mo9 O30 Mo7 140.3(7) 2_655 .
Mo10 O31 Mo11 140.3(5) . .
C32 C31 C30 119(3) . .
Mo8 O32 Mo9 139.7(6) . .
C31 C32 C33 123(2) . .
Mo12 O33 Mo10 139.1(5) . .
C34 C33 C32 118(2) . .
C29 C34 C33 121(2) . .
Mo7 O34 Mo11 140.0(8) . 2_655
C36 C35 C22 117.8(13) . .
C40 C35 C22 122.4(13) . .
C40 C35 C36 119.5(13) . .
Mo8 O35 Mo12 138.6(6) . .
C35 C36 C37 117.8(17) . .
Mo11 O36 Mo9 140.1(6) . .
Mo11 O37 Mo12 138.4(5) . .
C38 C37 C36 123.2(19) . .
Mo10 O38 Mo8 139.2(8) 2_655 .
C37 C38 C39 118.9(19) . .
Mo7 O39 Mo8 139.3(5) . .
C40 C39 C38 120.5(18) . .
C39 C40 C35 120.0(15) . .
Mo9 O40 Mo10 136.8(8) . 2_655
N5 C41 C42 118.2(12) . .
N5 C41 C49 118.2(11) . .
C42 C41 C49 123.5(12) . .
N6 C42 C41 122.1(12) . .
N6 C42 C55 116.8(11) . .
C41 C42 C55 121.0(12) . .
N6 C43 C44 122.1(11) . .
N6 C43 C48 118.9(11) . .
C44 C43 C48 119.0(12) . .
C45 C44 C43 120.4(13) . .
C44 C45 C46 121.2(14) . .
C47 C46 C45 120.9(14) . .
C46 C47 C48 119.4(12) . .
N5 C48 C43 120.1(11) . .
N5 C48 C47 120.8(11) . .
C47 C48 C43 119.1(12) . .
C50 C49 C41 121.1(15) . .
C50 C49 C54 117.6(16) . .
C54 C49 C41 121.3(15) . .
C51 C50 C49 120(2) . .
C52 C51 C50 118(2) . .
C51 C52 C53 125(2) . .
C52 C53 C54 117(2) . .
C53 C54 C49 122(2) . .
C56 C55 C42 118.4(14) . .
C60 C55 C42 121.8(15) . .
C60 C55 C56 119.1(15) . .
C55 C56 C57 122.1(18) . .
C58 C57 C56 113(2) . .
C59 C58 C57 123(2) . .
C58 C59 C60 123(2) . .
C55 C60 C59 118(2) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N1 2.145(9) .
Ag1 N6 2.152(9) 1_645
Mo1 O1 2.474(14) 2_756
Mo1 O1' 2.511(17) .
Mo1 O3 1.655(8) .
Mo1 O11 1.812(12) .
Mo1 O12 1.992(10) .
Mo1 O15 1.805(10) .
Mo1 O20 1.964(11) .
P1 O1 1.589(14) 2_756
P1 O1 1.589(14) .
P1 O1' 1.566(17) 2_756
P1 O1' 1.566(17) .
P1 O2' 1.424(14) 2_756
P1 O2' 1.425(14) .
P1 O2 1.543(15) .
P1 O2 1.543(15) 2_756
O1 Mo1 2.474(14) 2_756
O1 O2' 1.676(19) 2_756
O1 Mo4 2.494(15) 2_756
O1 Mo6 2.352(14) 2_756
O1' Mo2 2.361(18) .
O1' O2' 1.67(2) 2_756
O1' Mo5 2.489(17) .
N1 C1 1.348(16) .
N1 C8 1.356(16) .
C1 C2 1.422(16) .
C1 C9 1.480(19) .
Mo2 O7 1.647(10) .
Mo2 O9 1.828(9) 2_756
Mo2 O11 1.977(11) .
Mo2 O17 1.806(10) .
Mo2 O18 1.981(9) .
O2' O1 1.676(19) 2_756
O2' O1' 1.67(2) 2_756
O2' O2 1.59(2) 2_756
O2' Mo3 2.514(14) 2_756
O2 O2' 1.59(2) 2_756
O2 Mo3 2.364(15) .
O2 Mo5 2.505(14) 2_756
Ag2 N2 2.198(9) .
Ag2 N3 2.195(10) .
N2 C2 1.364(16) .
N2 C3 1.368(16) .
C2 C15 1.468(19) .
P2 O21' 1.612(16) 2_655
P2 O21' 1.612(16) .
P2 O21 1.625(17) 2_655
P2 O21 1.625(17) .
P2 O22' 1.487(15) .
P2 O22' 1.487(15) 2_655
P2 O22 1.378(16) .
P2 O22 1.378(16) 2_655
Mo3 O2' 2.514(14) 2_756
Mo3 O6 1.652(9) .
Mo3 O10 2.007(9) .
Mo3 O16 2.006(10) 2_756
Mo3 O18 1.803(9) .
Mo3 O19 1.807(10) .
Ag3 N4 2.229(9) .
Ag3 N5 2.224(9) .
C3 C4 1.388(18) .
C3 C8 1.429(16) .
N3 C21 1.313(15) .
N3 C28 1.335(15) .
Mo4 O1 2.494(15) 2_756
Mo4 O8 1.647(9) .
Mo4 O13 1.792(11) .
Mo4 O14 1.795(10) 2_756
Mo4 O15 1.988(11) .
Mo4 O19 2.001(10) .
O4 Mo6 1.638(10) .
C4 C5 1.35(2) .
N4 C22 1.342(16) .
N4 C23 1.365(16) .
Mo5 O2 2.505(14) 2_756
Mo5 O5 1.649(9) .
Mo5 O12 1.812(10) .
Mo5 O14 1.998(10) .
Mo5 O16 1.811(10) .
Mo5 O17 2.006(10) .
N5 C41 1.335(15) .
N5 C48 1.365(15) .
C5 C6 1.39(2) .
Mo6 O1 2.352(14) 2_756
Mo6 O9 1.970(9) .
Mo6 O10 1.796(9) 2_756
Mo6 O13 2.010(10) .
Mo6 O20 1.814(11) .
N6 Ag1 2.152(9) 1_465
N6 C42 1.296(15) .
N6 C43 1.374(14) .
C6 C7 1.33(2) .
C7 C8 1.413(19) .
Mo7 O21' 2.406(16) .
Mo7 O23 1.648(9) .
Mo7 O29 1.979(10) .
Mo7 O30 2.003(10) .
Mo7 O34 1.811(11) .
Mo7 O39 1.802(9) .
Mo8 O21 2.424(16) .
Mo8 O27 1.656(9) .
Mo8 O32 1.820(10) .
Mo8 O35 1.834(11) .
Mo8 O38 2.033(12) .
Mo8 O39 2.004(8) .
Mo9 O28 1.670(7) .
Mo9 O30 1.796(11) 2_655
Mo9 O32 1.979(11) .
Mo9 O36 2.007(12) .
Mo9 O40 1.832(12) .
O9 Mo2 1.828(9) 2_756
C9 C10 1.34(2) .
C9 C14 1.37(2) .
Mo10 O21 2.300(17) 2_655
Mo10 O25 1.514(10) .
Mo10 O31 1.801(8) .
Mo10 O33 1.999(9) .
Mo10 O38 1.767(11) 2_655
Mo10 O40 1.999(10) 2_655
O10 Mo6 1.797(8) 2_756
C10 C11 1.38(3) .
Mo11 O21' 2.347(16) 2_655
Mo11 O24 1.648(9) .
Mo11 O31 1.976(8) .
Mo11 O34 1.986(11) 2_655
Mo11 O36 1.790(11) .
Mo11 O37 1.827(9) .
C11 C12 1.40(3) .
Mo12 O22' 2.350(15) 2_655
Mo12 O22 2.459(16) .
Mo12 O26 1.655(10) .
Mo12 O29 1.818(9) .
Mo12 O33 1.799(9) .
Mo12 O35 1.983(10) .
Mo12 O37 1.986(9) .
C12 C13 1.34(2) .
C13 C14 1.38(2) .
O14 Mo4 1.795(10) 2_756
C15 C16 1.401(18) .
C15 C20 1.333(19) .
O16 Mo3 2.006(10) 2_756
C16 C17 1.38(2) .
C17 C18 1.33(2) .
C18 C19 1.38(2) .
C19 C20 1.38(2) .
C21 C22 1.445(17) .
C21 C29 1.455(19) .
O21' Mo11 2.347(16) 2_655
O21' O22 1.69(2) 2_655
O21 Mo10 2.300(17) 2_655
O21 O22 1.73(2) 2_655
C22 C35 1.470(18) .
O22' Mo12 2.350(15) 2_655
O22' O22 1.40(2) 2_655
O22 O21' 1.69(2) 2_655
O22 O21 1.73(2) 2_655
O22 O22' 1.40(2) 2_655
C23 C24 1.451(18) .
C23 C28 1.413(16) .
C24 C25 1.320(19) .
C25 C26 1.403(19) .
C26 C27 1.360(19) .
C27 C28 1.428(18) .
C29 C30 1.40(2) .
C29 C34 1.38(2) .
C30 C31 1.35(2) .
O30 Mo9 1.796(11) 2_655
C31 C32 1.32(3) .
C32 C33 1.39(3) .
C33 C34 1.39(2) .
O34 Mo11 1.986(11) 2_655
C35 C36 1.378(19) .
C35 C40 1.378(19) .
C36 C37 1.39(2) .
C37 C38 1.32(3) .
O38 Mo10 1.767(11) 2_655
C38 C39 1.37(2) .
C39 C40 1.367(19) .
O40 Mo10 1.999(10) 2_655
C41 C42 1.444(16) .
C41 C49 1.475(19) .
C42 C55 1.497(18) .
C43 C44 1.411(17) .
C43 C48 1.418(15) .
C44 C45 1.324(17) .
C45 C46 1.398(18) .
C46 C47 1.364(18) .
C47 C48 1.405(17) .
C49 C50 1.38(2) .
C49 C54 1.39(2) .
C50 C51 1.38(2) .
C51 C52 1.32(3) .
C52 C53 1.34(3) .
C53 C54 1.37(3) .
C55 C56 1.41(2) .
C55 C60 1.34(2) .
C56 C57 1.43(2) .
C57 C58 1.42(3) .
C58 C59 1.26(3) .
C59 C60 1.41(2) .
