#------------------------------------------------------------------------------
#$Date: 2025-07-06 19:38:09 +0300 (Sun, 06 Jul 2025) $
#$Revision: 300911 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/82/7718282.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_7718282
loop_
_publ_author_name
'Sun, Zhe'
'Yu, Xiaojing'
'Zhen, Qingfang'
'Yu, Tingting'
'Wang, Xinming'
'Yang, Guixin'
'Song, Yongbin'
'Pang, Haijun'
_publ_section_title
;
 Synthesis of two new polyoxometalate-based organic complexes from 2D to
 3D structures for improving supercapacitor performance.
;
_journal_issue                   15
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6093
_journal_page_last               6102
_journal_paper_doi               10.1039/d5dt00284b
_journal_volume                  54
_journal_year                    2025
_chemical_formula_moiety         'C48 H40 Ag4 Mo12 N16 O40 P'
_chemical_formula_sum            'C48 H40 Ag4 Mo12 N16 O40 P'
_chemical_formula_weight         3094.69
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014
_audit_update_record
;
2024-12-23 deposited with the CCDC.	2025-03-10 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 109.8060(10)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   17.1296(12)
_cell_length_b                   22.8733(17)
_cell_length_c                   20.1601(14)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      25.000
_cell_measurement_theta_min      7.5
_cell_volume                     7431.7(9)
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.973
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0247
_diffrn_reflns_av_unetI/netI     0.0281
_diffrn_reflns_Laue_measured_fraction_full 0.973
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       27
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            19148
_diffrn_reflns_point_group_measured_fraction_full 0.973
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.027
_diffrn_reflns_theta_min         1.546
_exptl_absorpt_coefficient_mu    3.102
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    2.766
_exptl_crystal_description       block
_exptl_crystal_F_000             5868
_refine_diff_density_max         2.744
_refine_diff_density_min         -1.270
_refine_diff_density_rms         0.162
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.008
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     566
_refine_ls_number_reflns         6549
_refine_ls_number_restraints     12
_refine_ls_restrained_S_all      1.021
_refine_ls_R_factor_all          0.0664
_refine_ls_R_factor_gt           0.0492
_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)+(0.0548P)²+201.8610P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1214
_refine_ls_wR_factor_ref         0.1330
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5164
_reflns_number_total             6565
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d5dt00284b2.cif
_cod_data_source_block           YY
_cod_depositor_comments
'Adding full bibliography for 7718281--7718282.cif.'
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               7718282
_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.
;
_shelxl_version_number           2014-3
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
P1 P 0.5000 0.25463(10) 0.2500 0.0132(5) Uani 1 2 d S T P . .
O1 O 0.4235(4) 0.1732(4) 0.3734(4) 0.057(2) Uani 1 1 d . . . . .
C1 C 0.6513(6) 0.5001(4) 0.0309(5) 0.042(2) Uani 1 1 d . . . . .
H1A H 0.6549 0.4900 -0.0127 0.050 Uiso 1 1 calc R U . . .
N1 N 0.8732(5) 0.5057(4) 0.0639(4) 0.044(2) Uani 1 1 d . . . . .
C2 C 0.5909(7) 0.4895(5) 0.1192(5) 0.049(3) Uani 1 1 d . . . . .
H2A H 0.5503 0.4725 0.1340 0.059 Uiso 1 1 calc R U . . .
N2 N 0.5952(5) 0.6028(3) 0.3433(4) 0.0418(19) Uani 1 1 d . . . . .
O2 O 0.5429(4) 0.1168(4) 0.3478(4) 0.065(3) Uani 1 1 d . . . . .
C3 C 0.6435(6) 0.6295(4) 0.4053(5) 0.039(2) Uani 1 1 d . . . . .
N3 N 0.8135(4) 0.5392(3) 0.0195(4) 0.0328(16) Uani 1 1 d . . . . .
O3 O 0.6505(4) 0.1980(3) 0.4128(5) 0.065(3) Uani 1 1 d . . . . .
C4 C 0.7650(6) 0.5770(4) 0.0502(6) 0.040(2) Uani 1 1 d . . . . .
H4A H 0.7357 0.6060 0.0157 0.048 Uiso 1 1 calc R U . . .
H4B H 0.8025 0.5974 0.0907 0.048 Uiso 1 1 calc R U . . .
N4 N 0.6420(5) 0.5281(3) 0.1619(4) 0.0376(18) Uani 1 1 d . . . . .
O4 O 0.3945(4) 0.3925(4) 0.2550(4) 0.066(3) Uani 1 1 d . . . . .
C5 C 0.7031(8) 0.6921(6) 0.5292(6) 0.063(3) Uani 1 1 d . . . . .
H5A H 0.7255 0.7130 0.5709 0.075 Uiso 1 1 calc R U . . .
N5 N 0.9094(5) 0.4772(4) 0.0260(4) 0.0424(19) Uani 1 1 d . . . . .
O5 O 0.8003(4) 0.2540(3) 0.4318(4) 0.0432(16) Uani 1 1 d . . . . .
C6 C 0.7280(7) 0.6256(5) 0.4439(6) 0.054(3) Uani 1 1 d . . . . .
H6A H 0.7636 0.6029 0.4285 0.065 Uiso 1 1 calc R U . . .
N6 N 0.5183(5) 0.6186(4) 0.3289(4) 0.046(2) Uani 1 1 d . . . . .
O6 O 0.6523(4) 0.3121(3) 0.4138(5) 0.059(2) Uani 1 1 d . . . . .
C7 C 0.5943(7) 0.4734(5) 0.0550(6) 0.054(3) Uani 1 1 d . . . . .
H7A H 0.5587 0.4449 0.0281 0.065 Uiso 1 1 calc R U . . .
N7 N 0.4442(5) 0.8456(4) 0.3468(5) 0.047(2) Uani 1 1 d . . . . .
O7 O 0.5615(4) 0.1396(3) 0.4853(3) 0.0421(16) Uani 1 1 d . . . . .
C8 C 0.6202(7) 0.6962(5) 0.4923(5) 0.045(2) Uani 1 1 d . . . . .
H8A H 0.5848 0.7193 0.5075 0.054 Uiso 1 1 calc R U . . .
N8 N 0.5140(5) 0.6551(3) 0.3799(4) 0.0409(19) Uani 1 1 d . . . . .
O8 O 0.5304(4) 0.2550(3) 0.4398(5) 0.056(2) Uani 1 1 d . . . . .
C9 C 0.7596(6) 0.5566(4) -0.1122(5) 0.040(2) Uani 1 1 d . . . . .
H9A H 0.7170 0.5828 -0.1153 0.048 Uiso 1 1 calc R U . . .
O9 O 0.5645(5) 0.3693(3) 0.4854(4) 0.057(2) Uani 1 1 d . . . . .
C10 C 0.4166(6) 0.8501(5) 0.2769(6) 0.050(3) Uani 1 1 d . . . . .
H10A H 0.4126 0.8870 0.2566 0.059 Uiso 1 1 calc R U . . .
O10 O 0.5000 0.4815(4) 0.2500 0.048(3) Uani 1 2 d S T P . .
C11 C 0.5914(6) 0.6627(4) 0.4291(5) 0.039(2) Uani 1 1 d . . . . .
O11 O 0.2617(4) 0.1400(3) 0.2995(4) 0.0465(17) Uani 1 1 d . . . . .
C12 C 0.3939(6) 0.8017(5) 0.2334(6) 0.049(3) Uani 1 1 d . . . . .
H12A H 0.3756 0.8060 0.1847 0.058 Uiso 1 1 calc R U . . .
O12 O 0.5454(4) 0.3933(4) 0.3483(4) 0.058(2) Uani 1 1 d . . . . .
C13 C 0.4488(6) 0.7919(5) 0.3756(6) 0.045(2) Uani 1 1 d . . . . .
H13A H 0.4672 0.7885 0.4245 0.054 Uiso 1 1 calc R U . . .
O13 O 0.2682(4) 0.3688(3) 0.3058(3) 0.0352(14) Uani 1 1 d . . . . .
C14 C 0.4340(6) 0.6846(4) 0.3719(6) 0.046(2) Uani 1 1 d . . . . .
H14A H 0.4294 0.6904 0.4181 0.056 Uiso 1 1 calc R U . . .
H14B H 0.3885 0.6597 0.3449 0.056 Uiso 1 1 calc R U . . .
O14 O 0.5961(6) 0.2527(4) 0.2581(5) 0.017(2) Uani 0.5 1 d . . P . .
C15 C 0.8108(5) 0.5329(4) -0.0472(5) 0.0320(19) Uani 1 1 d . . . . .
O15 O 0.5000 0.0270(4) 0.2500 0.054(3) Uani 1 2 d S T P . .
C16 C 0.7558(7) 0.6565(7) 0.5050(6) 0.067(4) Uani 1 1 d . . . . .
H16A H 0.8117 0.6543 0.5321 0.081 Uiso 1 1 calc R U . . .
O16 O 0.7126(7) 0.3121(3) 0.3102(4) 0.079(3) Uani 1 1 d . U . . .
C17 C 0.4276(5) 0.7422(4) 0.3357(5) 0.034(2) Uani 1 1 d . . . . .
O17 O 0.3927(4) 0.1159(3) 0.2538(3) 0.0487(18) Uani 1 1 d . . . . .
C18 C 0.3985(6) 0.7476(4) 0.2628(5) 0.042(2) Uani 1 1 d . . . . .
H18A H 0.3824 0.7147 0.2343 0.051 Uiso 1 1 calc R U . . .
O18 O 0.4814(5) 0.2002(4) 0.2838(5) 0.015(2) Uani 0.5 1 d . . P . .
C19 C 0.6981(5) 0.5533(4) 0.1382(5) 0.034(2) Uani 1 1 d . . . . .
H19A H 0.7355 0.5795 0.1678 0.041 Uiso 1 1 calc R U . . .
O19 O 0.5487(6) 0.2557(4) 0.3294(5) 0.017(2) Uani 0.5 1 d . . P . .
C20 C 0.8751(5) 0.4922(4) -0.0433(5) 0.035(2) Uani 1 1 d . . . . .
O20 O 0.4853(6) 0.3088(4) 0.2854(5) 0.015(2) Uani 0.5 1 d . . P . .
C21 C 0.7039(5) 0.5428(4) 0.0725(5) 0.0312(19) Uani 1 1 d . . . . .
O21 O 0.7123(7) 0.1963(3) 0.3114(3) 0.079(3) Uani 1 1 d . . . . .
C22 C 0.7775(6) 0.5379(4) -0.1707(5) 0.045(2) Uani 1 1 d . . . . .
H22A H 0.7453 0.5515 -0.2150 0.053 Uiso 1 1 calc R U . . .
O22 O 0.3169(7) 0.2539(3) 0.3077(4) 0.072(3) Uani 1 1 d . U . . .
C23 C 0.8433(7) 0.4984(4) -0.1652(6) 0.047(2) Uani 1 1 d . . . . .
H23A H 0.8539 0.4881 -0.2060 0.057 Uiso 1 1 calc R U . . .
O23 O 0.4283(4) 0.3349(4) 0.3741(4) 0.064(3) Uani 1 1 d . . . . .
C24 C 0.8913(6) 0.4752(4) -0.1032(5) 0.039(2) Uani 1 1 d . . . . .
H24A H 0.9335 0.4489 -0.1009 0.047 Uiso 1 1 calc R U . . .
Ag1 Ag 0.49515(6) 0.91740(4) 0.41696(6) 0.0646(3) Uani 1 1 d . . . . .
Mo2 Mo 0.33895(5) 0.17630(3) 0.28643(4) 0.0328(2) Uani 1 1 d . . . . .
Ag2 Ag 0.62438(6) 0.55677(4) 0.25959(4) 0.0512(2) Uani 1 1 d . . . . .
Mo3 Mo 0.54335(5) 0.17798(3) 0.41109(4) 0.03025(19) Uani 1 1 d . . . . .
Mo4 Mo 0.5000 0.40850(4) 0.2500 0.0328(3) Uani 1 2 d S T P . .
Mo5 Mo 0.54640(5) 0.33204(3) 0.41134(4) 0.02928(19) Uani 1 1 d . . . . .
Mo6 Mo 0.5000 0.09894(4) 0.2500 0.0277(2) Uani 1 2 d S T P . .
Mo7 Mo 0.70558(5) 0.25500(3) 0.37344(4) 0.0353(2) Uani 1 1 d . . . . .
Mo1 Mo 0.34123(5) 0.33139(4) 0.28818(4) 0.0377(2) 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'
P P 0.1023 0.0942 '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
_geom_angle_publ_flag
O20 P1 O20 67.8(7) 2_655 . ?
O20 P1 O18 177.6(5) 2_655 . ?
O20 P1 O18 112.0(5) . . ?
O20 P1 O18 112.0(5) 2_655 2_655 ?
O20 P1 O18 177.6(5) . 2_655 ?
O18 P1 O18 68.3(7) . 2_655 ?
O20 P1 O19 66.9(5) 2_655 2_655 ?
O20 P1 O19 111.4(5) . 2_655 ?
O18 P1 O19 111.3(5) . 2_655 ?
O18 P1 O19 70.4(5) 2_655 2_655 ?
O20 P1 O19 111.4(5) 2_655 . ?
O20 P1 O19 66.9(5) . . ?
O18 P1 O19 70.4(5) . . ?
O18 P1 O19 111.3(5) 2_655 . ?
O19 P1 O19 178.1(7) 2_655 . ?
O20 P1 O14 108.0(5) 2_655 2_655 ?
O20 P1 O14 74.7(5) . 2_655 ?
O18 P1 O14 69.8(5) . 2_655 ?
O18 P1 O14 107.5(5) 2_655 2_655 ?
O19 P1 O14 73.6(5) 2_655 2_655 ?
O19 P1 O14 106.5(5) . 2_655 ?
O20 P1 O14 74.7(5) 2_655 . ?
O20 P1 O14 108.0(5) . . ?
O18 P1 O14 107.5(5) . . ?
O18 P1 O14 69.8(5) 2_655 . ?
O19 P1 O14 106.5(5) 2_655 . ?
O19 P1 O14 73.6(5) . . ?
O14 P1 O14 176.8(7) 2_655 . ?
Mo2 O1 Mo3 138.8(4) . . ?
C7 C1 C21 119.3(9) . . ?
N5 N1 N3 107.4(8) . . ?
N4 C2 C7 124.2(9) . . ?
N6 N2 C3 109.2(7) . . ?
N6 N2 Ag2 116.1(6) . . ?
C3 N2 Ag2 133.3(7) . . ?
Mo3 O2 Mo6 140.4(5) . . ?
N2 C3 C11 107.4(9) . . ?
N2 C3 C6 131.6(9) . . ?
C11 C3 C6 121.0(10) . . ?
C15 N3 N1 111.4(7) . . ?
C15 N3 C4 130.8(8) . . ?
N1 N3 C4 117.7(8) . . ?
Mo3 O3 Mo7 140.0(4) . . ?
N3 C4 C21 111.8(7) . . ?
C2 N4 C19 116.5(8) . . ?
C2 N4 Ag2 121.3(6) . . ?
C19 N4 Ag2 121.7(6) . . ?
Mo4 O4 Mo1 138.0(4) . . ?
C8 C5 C16 121.2(11) . . ?
N1 N5 C20 110.3(8) . . ?
N1 N5 Ag1 115.5(6) . 4_645 ?
C20 N5 Ag1 134.1(7) . 4_645 ?
C16 C6 C3 116.7(11) . . ?
N2 N6 N8 108.3(8) . . ?
Mo5 O6 Mo7 139.1(5) . . ?
C2 C7 C1 118.6(9) . . ?
C10 N7 C13 118.3(9) . . ?
C10 N7 Ag1 123.9(8) . . ?
C13 N7 Ag1 117.5(7) . . ?
C5 C8 C11 115.5(10) . . ?
N6 N8 C11 110.0(8) . . ?
N6 N8 C14 119.0(8) . . ?
C11 N8 C14 130.6(8) . . ?
Mo3 O8 Mo5 136.6(5) . . ?
C22 C9 C15 115.1(8) . . ?
N7 C10 C12 122.1(11) . . ?
N8 C11 C3 105.0(8) . . ?
N8 C11 C8 132.3(9) . . ?
C3 C11 C8 122.7(10) . . ?
C18 C12 C10 119.3(10) . . ?
Mo5 O12 Mo4 138.2(5) . . ?
N7 C13 C17 122.6(10) . . ?
N8 C14 C17 111.5(8) . . ?
P1 O14 O18 52.6(4) . 2_655 ?
P1 O14 Mo2 125.0(5) . 2_655 ?
O18 O14 Mo2 72.3(4) 2_655 2_655 ?
P1 O14 Mo1 120.8(5) . 2_655 ?
O18 O14 Mo1 132.2(6) 2_655 2_655 ?
Mo2 O14 Mo1 94.3(3) 2_655 2_655 ?
P1 O14 Mo7 121.9(5) . . ?
O18 O14 Mo7 132.5(5) 2_655 . ?
Mo2 O14 Mo7 93.9(3) 2_655 . ?
Mo1 O14 Mo7 93.0(3) 2_655 . ?
N3 C15 C9 133.6(8) . . ?
N3 C15 C20 104.6(8) . . ?
C9 C15 C20 121.9(9) . . ?
C6 C16 C5 122.9(11) . . ?
Mo7 O16 Mo1 138.2(5) . 2_655 ?
C13 C17 C18 118.4(9) . . ?
C13 C17 C14 119.1(9) . . ?
C18 C17 C14 122.5(9) . . ?
Mo2 O17 Mo6 138.6(4) . . ?
C12 C18 C17 119.2(9) . . ?
P1 O18 O18 55.8(4) . 2_655 ?
P1 O18 O19 55.6(4) . . ?
O18 O18 O19 93.6(6) 2_655 . ?
P1 O18 O14 57.6(5) . 2_655 ?
O18 O18 O14 92.4(6) 2_655 2_655 ?
O19 O18 O14 90.7(6) . 2_655 ?
P1 O18 Mo6 125.8(5) . . ?
O18 O18 Mo6 69.9(2) 2_655 . ?
O19 O18 Mo6 134.6(5) . . ?
O14 O18 Mo6 130.5(5) 2_655 . ?
P1 O18 Mo3 123.9(5) . . ?
O18 O18 Mo3 133.7(7) 2_655 . ?
O19 O18 Mo3 68.3(4) . . ?
O14 O18 Mo3 128.4(6) 2_655 . ?
Mo6 O18 Mo3 92.5(3) . . ?
N4 C19 C21 124.0(8) . . ?
P1 O19 O20 55.3(4) . . ?
P1 O19 O18 54.0(4) . . ?
O20 O19 O18 93.1(6) . . ?
P1 O19 Mo5 126.7(5) . . ?
O20 O19 Mo5 71.3(5) . . ?
O18 O19 Mo5 136.3(6) . . ?
P1 O19 Mo3 124.0(5) . . ?
O20 O19 Mo3 136.1(6) . . ?
O18 O19 Mo3 70.0(4) . . ?
Mo5 O19 Mo3 93.0(3) . . ?
N5 C20 C24 132.9(9) . . ?
N5 C20 C15 106.2(8) . . ?
C24 C20 C15 120.9(9) . . ?
P1 O20 O20 56.1(3) . 2_655 ?
P1 O20 O19 57.7(5) . . ?
O20 O20 O19 97.1(7) 2_655 . ?
P1 O20 Mo4 126.0(5) . . ?
O20 O20 Mo4 69.9(2) 2_655 . ?
O19 O20 Mo4 136.5(6) . . ?
P1 O20 Mo5 126.3(5) . . ?
O20 O20 Mo5 137.6(8) 2_655 . ?
O19 O20 Mo5 68.6(4) . . ?
Mo4 O20 Mo5 92.9(3) . . ?
C19 C21 C1 117.2(8) . . ?
C19 C21 C4 118.8(8) . . ?
C1 C21 C4 124.0(8) . . ?
Mo7 O21 Mo2 138.6(5) . 2_655 ?
C9 C22 C23 122.0(9) . . ?
Mo1 O22 Mo2 139.1(6) . . ?
C24 C23 C22 122.7(10) . . ?
Mo1 O23 Mo5 140.6(5) . . ?
C23 C24 C20 117.4(9) . . ?
N5 Ag1 N7 155.0(3) 4_655 . ?
O11 Mo2 O1 103.9(4) . . ?
O11 Mo2 O17 101.4(3) . . ?
O1 Mo2 O17 89.1(3) . . ?
O11 Mo2 O22 101.7(4) . . ?
O1 Mo2 O22 88.5(3) . . ?
O17 Mo2 O22 156.7(4) . . ?
O11 Mo2 O21 99.8(4) . 2_655 ?
O1 Mo2 O21 156.2(4) . 2_655 ?
O17 Mo2 O21 85.7(3) . 2_655 ?
O22 Mo2 O21 87.3(3) . 2_655 ?
O11 Mo2 O14 156.8(4) . 2_655 ?
O1 Mo2 O14 93.9(4) . 2_655 ?
O17 Mo2 O14 93.4(3) . 2_655 ?
O22 Mo2 O14 63.7(4) . 2_655 ?
O21 Mo2 O14 63.4(4) 2_655 2_655 ?
N2 Ag2 N4 167.2(3) . . ?
O7 Mo3 O3 103.1(4) . . ?
O7 Mo3 O2 99.9(4) . . ?
O3 Mo3 O2 88.5(3) . . ?
O7 Mo3 O8 102.8(3) . . ?
O3 Mo3 O8 89.0(3) . . ?
O2 Mo3 O8 157.2(4) . . ?
O7 Mo3 O1 100.0(4) . . ?
O3 Mo3 O1 156.9(4) . . ?
O2 Mo3 O1 86.1(3) . . ?
O8 Mo3 O1 87.4(3) . . ?
O7 Mo3 O19 161.2(3) . . ?
O3 Mo3 O19 65.0(3) . . ?
O2 Mo3 O19 94.4(4) . . ?
O8 Mo3 O19 64.1(3) . . ?
O1 Mo3 O19 93.0(3) . . ?
O7 Mo3 O18 157.0(3) . . ?
O3 Mo3 O18 92.4(4) . . ?
O2 Mo3 O18 63.3(3) . . ?
O8 Mo3 O18 94.2(3) . . ?
O1 Mo3 O18 65.1(3) . . ?
O19 Mo3 O18 41.7(3) . . ?
O10 Mo4 O4 101.2(3) . . ?
O10 Mo4 O4 101.2(3) . 2_655 ?
O4 Mo4 O4 157.6(6) . 2_655 ?
O10 Mo4 O12 100.5(3) . 2_655 ?
O4 Mo4 O12 87.7(3) . 2_655 ?
O4 Mo4 O12 88.3(3) 2_655 2_655 ?
O10 Mo4 O12 100.5(3) . . ?
O4 Mo4 O12 88.3(3) . . ?
O4 Mo4 O12 87.7(3) 2_655 . ?
O12 Mo4 O12 158.9(5) 2_655 . ?
O10 Mo4 O20 159.9(2) . 2_655 ?
O4 Mo4 O20 91.8(4) . 2_655 ?
O4 Mo4 O20 66.7(3) 2_655 2_655 ?
O12 Mo4 O20 64.4(3) 2_655 2_655 ?
O12 Mo4 O20 95.0(3) . 2_655 ?
O10 Mo4 O20 159.9(2) . . ?
O4 Mo4 O20 66.7(3) . . ?
O4 Mo4 O20 91.8(4) 2_655 . ?
O12 Mo4 O20 95.0(3) 2_655 . ?
O12 Mo4 O20 64.4(3) . . ?
O20 Mo4 O20 40.1(4) 2_655 . ?
O9 Mo5 O6 102.7(4) . . ?
O9 Mo5 O12 100.4(4) . . ?
O6 Mo5 O12 89.2(3) . . ?
O9 Mo5 O8 102.0(4) . . ?
O6 Mo5 O8 90.2(3) . . ?
O12 Mo5 O8 157.2(4) . . ?
O9 Mo5 O23 100.8(4) . . ?
O6 Mo5 O23 156.5(4) . . ?
O12 Mo5 O23 86.7(3) . . ?
O8 Mo5 O23 84.8(3) . . ?
O9 Mo5 O19 161.6(4) . . ?
O6 Mo5 O19 66.2(4) . . ?
O12 Mo5 O19 94.3(4) . . ?
O8 Mo5 O19 64.8(4) . . ?
O23 Mo5 O19 90.9(4) . . ?
O9 Mo5 O20 158.3(4) . . ?
O6 Mo5 O20 92.6(4) . . ?
O12 Mo5 O20 64.0(3) . . ?
O8 Mo5 O20 93.3(4) . . ?
O23 Mo5 O20 64.9(3) . . ?
O19 Mo5 O20 40.1(3) . . ?
O15 Mo6 O2 102.4(3) . . ?
O15 Mo6 O2 102.4(3) . 2_655 ?
O2 Mo6 O2 155.2(6) . 2_655 ?
O15 Mo6 O17 101.8(2) . . ?
O2 Mo6 O17 87.3(3) . . ?
O2 Mo6 O17 87.6(3) 2_655 . ?
O15 Mo6 O17 101.8(2) . 2_655 ?
O2 Mo6 O17 87.6(3) . 2_655 ?
O2 Mo6 O17 87.3(3) 2_655 2_655 ?
O17 Mo6 O17 156.5(5) . 2_655 ?
O15 Mo6 O18 159.9(2) . 2_655 ?
O2 Mo6 O18 92.5(4) . 2_655 ?
O2 Mo6 O18 63.4(3) 2_655 2_655 ?
O17 Mo6 O18 92.1(3) . 2_655 ?
O17 Mo6 O18 65.2(3) 2_655 2_655 ?
O15 Mo6 O18 159.9(2) . . ?
O2 Mo6 O18 63.4(3) . . ?
O2 Mo6 O18 92.5(4) 2_655 . ?
O17 Mo6 O18 65.2(3) . . ?
O17 Mo6 O18 92.1(3) 2_655 . ?
O18 Mo6 O18 40.1(4) 2_655 . ?
O5 Mo7 O16 102.8(4) . . ?
O5 Mo7 O21 101.5(4) . . ?
O16 Mo7 O21 90.7(3) . . ?
O5 Mo7 O6 101.6(3) . . ?
O16 Mo7 O6 87.9(4) . . ?
O21 Mo7 O6 156.6(4) . . ?
O5 Mo7 O3 101.4(4) . . ?
O16 Mo7 O3 155.7(4) . . ?
O21 Mo7 O3 86.6(4) . . ?
O6 Mo7 O3 85.2(3) . . ?
O5 Mo7 O14 158.5(3) . . ?
O16 Mo7 O14 64.5(4) . . ?
O21 Mo7 O14 63.1(4) . . ?
O6 Mo7 O14 95.5(3) . . ?
O3 Mo7 O14 93.0(4) . . ?
O13 Mo1 O23 101.8(3) . . ?
O13 Mo1 O22 101.8(4) . . ?
O23 Mo1 O22 90.6(3) . . ?
O13 Mo1 O4 100.5(3) . . ?
O23 Mo1 O4 88.1(3) . . ?
O22 Mo1 O4 157.4(4) . . ?
O13 Mo1 O16 101.9(4) . 2_655 ?
O23 Mo1 O16 156.2(4) . 2_655 ?
O22 Mo1 O16 86.4(3) . 2_655 ?
O4 Mo1 O16 85.8(4) . 2_655 ?
O13 Mo1 O14 158.4(3) . 2_655 ?
O23 Mo1 O14 94.0(4) . 2_655 ?
O22 Mo1 O14 62.9(4) . 2_655 ?
O4 Mo1 O14 94.7(4) . 2_655 ?
O16 Mo1 O14 63.7(4) 2_655 2_655 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
P1 O20 1.493(9) 2_655 ?
P1 O20 1.493(9) . ?
P1 O18 1.505(10) . ?
P1 O18 1.505(10) 2_655 ?
P1 O19 1.535(9) 2_655 ?
P1 O19 1.535(9) . ?
P1 O14 1.598(10) 2_655 ?
P1 O14 1.598(10) . ?
O1 Mo2 1.859(7) . ?
O1 Mo3 1.935(7) . ?
C1 C7 1.373(14) . ?
C1 C21 1.398(12) . ?
N1 N5 1.309(11) . ?
N1 N3 1.347(11) . ?
C2 N4 1.334(13) . ?
C2 C7 1.366(14) . ?
N2 N6 1.301(11) . ?
N2 C3 1.385(13) . ?
N2 Ag2 2.186(8) . ?
O2 Mo3 1.893(7) . ?
O2 Mo6 1.900(6) . ?
C3 C11 1.375(13) . ?
C3 C6 1.396(14) . ?
N3 C15 1.339(12) . ?
N3 C4 1.471(11) . ?
O3 Mo3 1.880(7) . ?
O3 Mo7 1.931(7) . ?
C4 C21 1.494(12) . ?
N4 C19 1.340(11) . ?
N4 Ag2 2.190(8) . ?
O4 Mo4 1.881(6) . ?
O4 Mo1 1.909(7) . ?
C5 C8 1.365(16) . ?
C5 C16 1.417(17) . ?
N5 C20 1.363(12) . ?
N5 Ag1 2.142(8) 4_645 ?
O5 Mo7 1.650(6) . ?
C6 C16 1.360(17) . ?
N6 N8 1.345(11) . ?
O6 Mo5 1.855(6) . ?
O6 Mo7 1.924(7) . ?
N7 C10 1.330(14) . ?
N7 C13 1.349(14) . ?
N7 Ag1 2.149(8) . ?
O7 Mo3 1.671(6) . ?
C8 C11 1.424(13) . ?
N8 C11 1.371(13) . ?
N8 C14 1.486(12) . ?
O8 Mo3 1.891(7) . ?
O8 Mo5 1.902(6) . ?
C9 C22 1.384(14) . ?
C9 C15 1.414(13) . ?
O9 Mo5 1.655(6) . ?
C10 C12 1.384(15) . ?
O10 Mo4 1.670(9) . ?
O11 Mo2 1.657(6) . ?
C12 C18 1.361(15) . ?
O12 Mo5 1.888(6) . ?
O12 Mo4 1.900(7) . ?
C13 C17 1.369(13) . ?
O13 Mo1 1.650(6) . ?
C14 C17 1.492(14) . ?
O14 O18 1.777(13) 2_655 ?
O14 Mo2 2.403(10) 2_655 ?
O14 Mo1 2.438(9) 2_655 ?
O14 Mo7 2.444(9) . ?
C15 C20 1.424(12) . ?
O15 Mo6 1.646(9) . ?
O16 Mo7 1.856(8) . ?
O16 Mo1 1.934(8) 2_655 ?
C17 C18 1.389(14) . ?
O17 Mo2 1.896(6) . ?
O17 Mo6 1.906(6) . ?
O18 O18 1.691(19) 2_655 ?
O18 O19 1.753(13) . ?
O18 O14 1.777(13) 2_655 ?
O18 Mo6 2.465(9) . ?
O18 Mo3 2.474(9) . ?
C19 C21 1.383(12) . ?
O19 O20 1.670(13) . ?
O19 Mo5 2.412(9) . ?
O19 Mo3 2.446(10) . ?
C20 C24 1.383(13) . ?
O20 O20 1.666(18) 2_655 ?
O20 Mo4 2.428(9) . ?
O20 Mo5 2.455(9) . ?
O21 Mo7 1.864(7) . ?
O21 Mo2 1.923(7) 2_655 ?
C22 C23 1.419(14) . ?
O22 Mo1 1.893(8) . ?
O22 Mo2 1.894(7) . ?
C23 C24 1.350(14) . ?
O23 Mo1 1.865(7) . ?
O23 Mo5 1.905(6) . ?
Ag1 N5 2.143(8) 4_655 ?
Mo2 O21 1.922(7) 2_655 ?
Mo2 O14 2.403(10) 2_655 ?
Mo4 O4 1.881(6) 2_655 ?
Mo4 O12 1.900(7) 2_655 ?
Mo4 O20 2.428(9) 2_655 ?
Mo6 O2 1.900(6) 2_655 ?
Mo6 O17 1.906(6) 2_655 ?
Mo6 O18 2.465(9) 2_655 ?
Mo1 O16 1.934(8) 2_655 ?
Mo1 O14 2.438(9) 2_655 ?
