#------------------------------------------------------------------------------
#$Date: 2016-03-24 14:07:12 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179652 $
#$URL: svn://www.crystallography.net/cod/cif/4/51/05/4510589.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_4510589
loop_
_publ_author_name
'Li, Meng-Ting'
'Sha, Jing-Quan'
'Zong, Xi-Ming'
'Sun, Jing-Wen'
'Yan, Peng-Fei'
'Li, Liang'
'Yang, Xiao-Ning'
_publ_section_title
;
 Assembly of Polyoxometalate-Based Hybrids with Different Helical Channels
 upon Subtle Ligand Variation
;
_journal_issue                   6
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              2794
_journal_paper_doi               10.1021/cg500045q
_journal_volume                  14
_journal_year                    2014
_chemical_formula_moiety         'C18 H10 Ag3 Mo12 N14 O40 P'
_chemical_formula_sum            'C18 H10 Ag3 Mo12 N14 O40 P'
_chemical_formula_weight         2568.26
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 96.776(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   10.385(5)
_cell_length_b                   32.060(5)
_cell_length_c                   31.248(5)
_cell_measurement_temperature    293(2)
_cell_volume                     10331(5)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'multiwire proportional'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0248
_diffrn_reflns_av_sigmaI/netI    0.0261
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       38
_diffrn_reflns_limit_k_min       -33
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            29153
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.43
_exptl_absorpt_coefficient_mu    4.064
_exptl_absorpt_correction_T_max  0.481
_exptl_absorpt_correction_T_min  0.323
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   adabs(Sheldrick,1996)
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    3.303
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             9568.0
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.18
_refine_diff_density_max         0.796
_refine_diff_density_min         -0.906
_refine_diff_density_rms         0.113
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     794
_refine_ls_number_reflns         9121
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.056
_refine_ls_R_factor_all          0.0314
_refine_ls_R_factor_gt           0.0245
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0190P)²+55.1143P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0513
_refine_ls_wR_factor_ref         0.0537
_reflns_number_gt                7971
_reflns_number_total             9121
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg500045q_si_002.cif
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/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 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 4510589--4510591.cif.
;
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               4510589
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
C1 C 0.2574(4) 0.39088(15) -0.19653(15) 0.0233(11) Uani 1 1 d .
C2 C 0.3055(5) 0.34000(15) -0.15594(15) 0.0229(11) Uani 1 1 d .
C3 C 0.3768(5) 0.31221(14) -0.12435(15) 0.0229(11) Uani 1 1 d .
C4 C 0.5111(5) 0.31530(16) -0.11694(17) 0.0302(12) Uani 1 1 d .
H4 H 0.5552 0.3332 -0.1336 0.036 Uiso 1 1 calc R
C5 C 0.5782(6) 0.29208(18) -0.08516(19) 0.0410(15) Uani 1 1 d .
H5 H 0.6680 0.2942 -0.0799 0.049 Uiso 1 1 calc R
C6 C 0.3859(7) 0.26093(18) -0.06899(19) 0.0486(17) Uani 1 1 d .
H6 H 0.3455 0.2418 -0.0526 0.058 Uiso 1 1 calc R
C7 C 0.3135(6) 0.28371(17) -0.10070(18) 0.0416(15) Uani 1 1 d .
H7 H 0.2242 0.2800 -0.1061 0.050 Uiso 1 1 calc R
C8 C 0.2588(4) 0.43131(14) -0.21751(15) 0.0221(10) Uani 1 1 d .
C9 C 0.2038(4) 0.48425(14) -0.25340(15) 0.0222(11) Uani 1 1 d .
H9 H 0.1565 0.5032 -0.2715 0.027 Uiso 1 1 calc R
C10 C -0.3020(4) 0.24676(13) -0.27052(14) 0.0135(9) Uani 1 1 d .
H10 H -0.3499 0.2314 -0.2921 0.016 Uiso 1 1 calc R
C11 C -0.2449(4) 0.29241(14) -0.22433(15) 0.0227(11) Uani 1 1 d .
C12 C -0.2433(4) 0.32996(15) -0.19811(15) 0.0221(10) Uani 1 1 d .
C13 C -0.1874(4) 0.37669(15) -0.15342(16) 0.0236(11) Uani 1 1 d .
C14 C -0.1126(5) 0.40222(16) -0.12003(16) 0.0267(11) Uani 1 1 d .
C15 C -0.1367(6) 0.44434(17) -0.1170(2) 0.0454(16) Uani 1 1 d .
H15 H -0.2022 0.4569 -0.1355 0.054 Uiso 1 1 calc R
C16 C -0.0635(7) 0.46738(19) -0.0867(2) 0.0553(19) Uani 1 1 d .
H16 H -0.0798 0.4958 -0.0845 0.066 Uiso 1 1 calc R
C17 C -0.0160(6) 0.38425(17) -0.09176(19) 0.0404(15) Uani 1 1 d .
H17 H 0.0008 0.3558 -0.0930 0.048 Uiso 1 1 calc R
C18 C 0.0553(6) 0.4092(2) -0.06155(19) 0.0461(16) Uani 1 1 d .
H18 H 0.1201 0.3974 -0.0422 0.055 Uiso 1 1 calc R
Ag1 Ag 0.0000 0.37208(2) -0.2500 0.03619(15) Uani 1 2 d S
Ag2 Ag 0.53430(4) 0.432181(14) -0.165826(17) 0.04304(12) Uani 1 1 d .
Ag3 Ag -0.5000 0.355294(19) -0.2500 0.03342(14) Uani 1 2 d S
Ag4 Ag 0.03137(4) 0.284207(13) -0.176998(14) 0.03390(10) Uani 1 1 d .
Mo1 Mo -0.37705(4) 0.069016(13) -0.161440(13) 0.02123(10) Uani 1 1 d .
Mo2 Mo -0.36671(4) 0.067494(12) -0.042274(13) 0.01917(9) Uani 1 1 d .
Mo3 Mo -0.31847(4) 0.170715(12) -0.025762(13) 0.01972(9) Uani 1 1 d .
Mo4 Mo -0.09970(4) 0.100582(12) 0.023496(13) 0.01912(9) Uani 1 1 d .
Mo5 Mo 0.13922(4) 0.166774(13) -0.024785(13) 0.02193(10) Uani 1 1 d .
Mo6 Mo -0.08498(4) 0.226832(12) -0.086813(13) 0.02141(10) Uani 1 1 d .
Mo7 Mo 0.13696(4) 0.169760(13) -0.134551(13) 0.02059(9) Uani 1 1 d .
Mo8 Mo 0.14048(4) 0.052041(12) -0.041109(13) 0.01897(9) Uani 1 1 d .
Mo9 Mo -0.12732(4) 0.005731(12) -0.094818(13) 0.01989(9) Uani 1 1 d .
Mo10 Mo -0.37704(4) 0.175165(13) -0.145930(13) 0.02088(9) Uani 1 1 d .
Mo11 Mo 0.09012(4) 0.056572(13) -0.150876(13) 0.01981(9) Uani 1 1 d .
Mo12 Mo -0.15534(4) 0.130338(13) -0.203817(13) 0.02048(9) Uani 1 1 d .
N1 N 0.0317(4) 0.44979(14) -0.05995(14) 0.0370(11) Uani 1 1 d .
N2 N 0.1857(4) 0.33202(12) -0.17494(13) 0.0242(9) Uani 1 1 d .
N3 N -0.2999(4) 0.38976(12) -0.17467(13) 0.0254(9) Uani 1 1 d .
N4 N 0.3619(4) 0.45711(12) -0.21063(13) 0.0265(10) Uani 1 1 d .
N5 N 0.1546(4) 0.36586(12) -0.20118(14) 0.0273(10) Uani 1 1 d .
N6 N 0.3226(6) 0.49137(16) -0.23370(17) 0.0533(14) Uani 1 1 d .
N7 N -0.3355(4) 0.35872(12) -0.20369(13) 0.0243(9) Uani 1 1 d .
N8 N -0.1478(4) 0.33935(12) -0.16675(13) 0.0245(9) Uani 1 1 d .
N9 N 0.5145(5) 0.26646(14) -0.06180(16) 0.0453(13) Uani 1 1 d .
N10 N -0.1840(5) 0.23670(15) -0.25259(16) 0.0479(13) Uani 1 1 d .
N11 N -0.1435(4) 0.26519(12) -0.22216(13) 0.0244(9) Uani 1 1 d .
N12 N 0.3543(4) 0.37635(12) -0.16881(13) 0.0235(9) Uani 1 1 d .
N13 N 0.1609(4) 0.44631(14) -0.24395(15) 0.0377(12) Uani 1 1 d .
N14 N -0.3435(4) 0.28230(14) -0.25331(14) 0.0324(11) Uani 1 1 d .
O1 O 0.0429(3) 0.22353(9) -0.12425(10) 0.0222(7) Uani 1 1 d .
O2 O 0.0552(3) 0.21750(9) -0.03828(10) 0.0219(7) Uani 1 1 d .
O3 O 0.2650(3) 0.18088(11) 0.01094(11) 0.0333(9) Uani 1 1 d .
O4 O 0.0209(3) 0.14637(10) 0.00920(10) 0.0238(7) Uani 1 1 d .
O5 O -0.2221(3) 0.14997(9) 0.02233(10) 0.0216(7) Uani 1 1 d .
O6 O -0.4244(3) 0.11893(9) -0.02669(10) 0.0220(7) Uani 1 1 d .
O7 O -0.4153(3) 0.07129(10) -0.10054(10) 0.0223(7) Uani 1 1 d .
O8 O 0.0208(3) 0.00495(9) -0.05477(10) 0.0210(7) Uani 1 1 d .
O10 O -0.4997(3) 0.03937(11) -0.18500(11) 0.0306(8) Uani 1 1 d .
O11 O -0.2525(3) 0.03039(10) -0.14163(10) 0.0227(7) Uani 1 1 d .
O12 O -0.0404(3) 0.08075(10) -0.18710(10) 0.0233(7) Uani 1 1 d .
O13 O -0.0383(3) 0.07598(9) -0.09352(9) 0.0168(7) Uani 1 1 d .
O14 O -0.1920(3) 0.11495(9) -0.05164(9) 0.0161(7) Uani 1 1 d .
O15 O -0.0240(3) 0.15374(9) -0.08665(10) 0.0182(7) Uani 1 1 d .
O16 O -0.2125(3) 0.12080(9) -0.13196(9) 0.0169(7) Uani 1 1 d .
O17 O -0.2211(3) 0.21115(10) -0.12600(10) 0.0231(7) Uani 1 1 d .
O18 O 0.2206(3) 0.17565(10) -0.07997(10) 0.0232(7) Uani 1 1 d .
O19 O 0.2438(3) 0.18981(11) -0.16521(11) 0.0291(8) Uani 1 1 d .
O20 O -0.2472(3) 0.06858(9) 0.01309(10) 0.0212(7) Uani 1 1 d .
O21 O 0.2592(3) 0.03008(10) -0.00717(11) 0.0250(8) Uani 1 1 d .
O22 O -0.2364(3) 0.02711(9) -0.05836(10) 0.0207(7) Uani 1 1 d .
O23 O -0.0619(3) 0.09600(10) 0.07708(10) 0.0273(8) Uani 1 1 d .
O24 O -0.0199(3) 0.16165(10) -0.17788(10) 0.0222(7) Uani 1 1 d .
O25 O -0.4857(3) 0.21231(10) -0.16391(11) 0.0290(8) Uani 1 1 d .
O26 O -0.2833(3) 0.16925(10) -0.19749(10) 0.0225(7) Uani 1 1 d .
O27 O 0.1914(3) 0.03758(11) -0.18407(11) 0.0304(8) Uani 1 1 d .
O28 O -0.1411(3) 0.13437(11) -0.25631(10) 0.0276(8) Uani 1 1 d .
O29 O 0.1969(3) 0.04453(10) -0.09425(10) 0.0221(7) Uani 1 1 d .
O30 O -0.4214(3) 0.20348(10) -0.00483(11) 0.0289(8) Uani 1 1 d .
O31 O -0.1705(3) -0.04465(10) -0.09904(11) 0.0287(8) Uani 1 1 d .
O32 O -0.4790(3) 0.03497(10) -0.02630(10) 0.0256(8) Uani 1 1 d .
O33 O -0.4589(3) 0.12571(10) -0.16234(10) 0.0232(7) Uani 1 1 d .
O34 O -0.3915(3) 0.17183(10) -0.08803(10) 0.0232(7) Uani 1 1 d .
O35 O -0.2938(3) 0.08653(10) -0.20689(10) 0.0230(7) Uani 1 1 d .
O36 O 0.1575(3) 0.11328(10) -0.13897(10) 0.0219(7) Uani 1 1 d .
O37 O -0.1039(4) 0.27865(10) -0.08380(11) 0.0327(9) Uani 1 1 d .
O38 O 0.1819(3) 0.10827(9) -0.03583(10) 0.0218(7) Uani 1 1 d .
O39 O -0.1954(3) 0.20678(10) -0.04253(10) 0.0246(7) Uani 1 1 d .
O40 O 0.0121(3) 0.06652(9) -0.00011(10) 0.0212(7) Uani 1 1 d .
P1 P -0.11669(11) 0.11633(3) -0.09106(4) 0.0143(2) Uani 1 1 d .
O9 O -0.0037(3) 0.00889(10) -0.13935(10) 0.0231(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'
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'
H H 0.0000 0.0000 '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
N5 C1 N12 113.3(4) . .
N5 C1 C8 122.7(4) . .
N12 C1 C8 123.9(4) . .
N2 C2 N12 113.2(4) . .
N2 C2 C3 123.5(4) . .
N12 C2 C3 123.3(4) . .
C7 C3 C4 119.1(5) . .
C7 C3 C2 121.8(5) . .
C4 C3 C2 119.1(4) . .
C5 C4 C3 119.9(5) . .
N9 C5 C4 119.5(5) . .
N9 C6 C7 119.9(6) . .
C6 C7 C3 118.6(6) . .
N13 C8 N4 114.4(4) . .
N13 C8 C1 123.9(4) . .
N4 C8 C1 121.7(4) . .
N6 C9 N13 111.6(4) . .
N10 C10 N14 111.1(4) . .
N14 C11 N11 114.1(4) . .
N14 C11 C12 123.0(4) . .
N11 C11 C12 122.9(4) . .
N7 C12 N8 113.5(4) . .
N7 C12 C11 122.8(4) . .
N8 C12 C11 123.7(4) . .
N3 C13 N8 113.8(4) . .
N3 C13 C14 122.2(4) . .
N8 C13 C14 123.9(4) . .
C15 C14 C17 119.2(5) . .
C15 C14 C13 120.5(5) . .
C17 C14 C13 120.2(5) . .
C16 C15 C14 119.3(5) . .
N1 C16 C15 121.0(6) . .
C14 C17 C18 119.0(5) . .
N1 C18 C17 120.4(5) . .
N5 Ag1 N5 169.0(2) . 2_554
N3 Ag2 N4 134.14(15) 1_655 .
N3 Ag2 N12 97.96(14) 1_655 .
N4 Ag2 N12 73.05(13) . .
N7 Ag3 N7 174.0(2) . 2_454
N2 Ag4 N11 137.26(14) . .
N2 Ag4 O1 122.16(12) . .
N11 Ag4 O1 99.91(12) . .
N2 Ag4 N8 92.96(14) . .
N11 Ag4 N8 74.11(13) . .
O1 Ag4 N8 114.70(12) . .
O10 Mo1 O35 103.58(15) . .
O10 Mo1 O11 103.38(15) . .
O35 Mo1 O11 95.15(14) . .
O10 Mo1 O7 102.25(15) . .
O35 Mo1 O7 153.36(13) . .
O11 Mo1 O7 85.12(13) . .
O10 Mo1 O33 101.99(15) . .
O35 Mo1 O33 87.10(14) . .
O11 Mo1 O33 153.23(13) . .
O7 Mo1 O33 81.27(13) . .
O10 Mo1 O16 172.15(14) . .
O35 Mo1 O16 73.50(12) . .
O11 Mo1 O16 84.24(12) . .
O7 Mo1 O16 80.04(11) . .
O33 Mo1 O16 70.79(11) . .
O32 Mo2 O7 102.48(15) . .
O32 Mo2 O6 102.60(15) . .
O7 Mo2 O6 98.23(14) . .
O32 Mo2 O22 100.86(15) . .
O7 Mo2 O22 84.71(13) . .
O6 Mo2 O22 155.09(13) . .
O32 Mo2 O20 97.73(14) . .
O7 Mo2 O20 157.50(13) . .
O6 Mo2 O20 86.78(13) . .
O22 Mo2 O20 81.87(13) . .
O32 Mo2 O14 169.75(13) . .
O7 Mo2 O14 87.74(12) . .
O6 Mo2 O14 74.92(12) . .
O22 Mo2 O14 80.51(12) . .
O20 Mo2 O14 72.32(11) . .
O30 Mo3 O5 102.61(15) . .
O30 Mo3 O39 102.23(16) . .
O5 Mo3 O39 97.54(14) . .
O30 Mo3 O6 98.68(15) . .
O5 Mo3 O6 87.51(13) . .
O39 Mo3 O6 156.81(13) . .
O30 Mo3 O34 100.44(14) . .
O5 Mo3 O34 155.76(13) . .
O39 Mo3 O34 84.74(14) . .
O6 Mo3 O34 81.70(13) . .
O30 Mo3 O14 170.78(14) . .
O5 Mo3 O14 74.90(12) . .
O39 Mo3 O14 86.95(12) . .
O6 Mo3 O14 72.47(12) . .
O34 Mo3 O14 81.16(11) . .
O23 Mo4 O40 105.49(15) . .
O23 Mo4 O20 102.66(15) . .
O40 Mo4 O20 98.74(14) . .
O23 Mo4 O4 101.91(15) . .
O40 Mo4 O4 84.49(14) . .
O20 Mo4 O4 153.33(13) . .
O23 Mo4 O5 99.12(14) . .
O40 Mo4 O5 153.26(13) . .
O20 Mo4 O5 85.70(13) . .
O4 Mo4 O5 80.32(13) . .
O23 Mo4 O14 168.91(13) . .
O40 Mo4 O14 85.47(12) . .
O20 Mo4 O14 73.42(12) . .
O4 Mo4 O14 80.51(11) . .
O5 Mo4 O14 70.46(11) . .
O3 Mo5 O4 103.46(16) . .
O3 Mo5 O2 102.80(15) . .
O4 Mo5 O2 96.54(14) . .
O3 Mo5 O38 101.53(15) . .
O4 Mo5 O38 86.67(14) . .
O2 Mo5 O38 153.96(13) . .
O3 Mo5 O18 99.11(16) . .
O4 Mo5 O18 156.34(13) . .
O2 Mo5 O18 85.21(13) . .
O38 Mo5 O18 81.91(13) . .
O3 Mo5 O15 169.25(15) . .
O4 Mo5 O15 87.00(12) . .
O2 Mo5 O15 73.12(12) . .
O38 Mo5 O15 81.28(11) . .
O18 Mo5 O15 70.86(11) . .
O37 Mo6 O17 102.94(16) . .
O37 Mo6 O1 100.79(16) . .
O17 Mo6 O1 96.62(14) . .
O37 Mo6 O2 100.68(15) . .
O17 Mo6 O2 154.72(13) . .
O1 Mo6 O2 87.64(14) . .
O37 Mo6 O39 101.47(15) . .
O17 Mo6 O39 85.07(14) . .
O1 Mo6 O39 156.70(13) . .
O2 Mo6 O39 81.54(13) . .
O37 Mo6 O15 171.35(14) . .
O17 Mo6 O15 85.22(12) . .
O1 Mo6 O15 75.10(12) . .
O2 Mo6 O15 71.77(11) . .
O39 Mo6 O15 81.91(12) . .
O19 Mo7 O18 102.69(15) . .
O19 Mo7 O36 104.19(16) . .
O18 Mo7 O36 97.22(14) . .
O19 Mo7 O24 101.72(15) . .
O18 Mo7 O24 154.09(13) . .
O36 Mo7 O24 85.04(13) . .
O19 Mo7 O1 97.37(15) . .
O18 Mo7 O1 87.06(13) . .
O36 Mo7 O1 156.44(13) . .
O24 Mo7 O1 81.34(13) . .
O19 Mo7 O15 169.64(14) . .
O18 Mo7 O15 74.49(12) . .
O36 Mo7 O15 86.12(12) . .
O24 Mo7 O15 79.95(12) . .
O1 Mo7 O15 72.67(11) . .
O21 Mo8 O29 103.07(15) . .
O21 Mo8 O38 101.84(15) . .
O29 Mo8 O38 96.43(14) . .
O21 Mo8 O8 102.28(14) . .
O29 Mo8 O8 87.93(14) . .
O38 Mo8 O8 153.81(13) . .
O21 Mo8 O40 100.78(15) . .
O29 Mo8 O40 155.66(13) . .
O38 Mo8 O40 83.31(13) . .
O8 Mo8 O40 82.31(13) . .
O21 Mo8 O13 173.49(13) . .
O29 Mo8 O13 74.60(12) . .
O38 Mo8 O13 84.53(12) . .
O8 Mo8 O13 71.72(11) . .
O40 Mo8 O13 81.16(11) . .
O31 Mo9 O22 103.29(15) . .
O31 Mo9 O8 103.40(15) . .
O22 Mo9 O8 96.28(14) . .
O31 Mo9 O11 100.26(15) . .
O22 Mo9 O11 84.88(13) . .
O8 Mo9 O11 155.34(13) . .
O31 Mo9 O9 100.45(15) . .
O22 Mo9 O9 155.06(13) . .
O8 Mo9 O9 85.47(13) . .
O11 Mo9 O9 83.50(13) . .
O31 Mo9 O13 171.98(14) . .
O22 Mo9 O13 84.55(12) . .
O8 Mo9 O13 73.71(11) . .
O11 Mo9 O13 81.92(11) . .
O9 Mo9 O13 72.02(11) . .
O25 Mo10 O34 103.87(15) . .
O25 Mo10 O33 104.22(15) . .
O34 Mo10 O33 97.79(14) . .
O25 Mo10 O26 99.74(15) . .
O34 Mo10 O26 153.90(13) . .
O33 Mo10 O26 86.93(14) . .
O25 Mo10 O17 100.31(15) . .
O34 Mo10 O17 83.42(13) . .
O33 Mo10 O17 154.33(13) . .
O26 Mo10 O17 81.56(13) . .
O25 Mo10 O16 170.77(14) . .
O34 Mo10 O16 85.36(12) . .
O33 Mo10 O16 74.11(12) . .
O26 Mo10 O16 71.20(11) . .
O17 Mo10 O16 80.46(11) . .
O27 Mo11 O12 104.11(16) . .
O27 Mo11 O9 101.61(16) . .
O12 Mo11 O9 95.78(14) . .
O27 Mo11 O36 102.55(15) . .
O12 Mo11 O36 86.94(13) . .
O9 Mo11 O36 154.22(14) . .
O27 Mo11 O29 98.84(15) . .
O12 Mo11 O29 156.26(13) . .
O9 Mo11 O29 85.36(13) . .
O36 Mo11 O29 82.20(13) . .
O27 Mo11 O13 170.15(14) . .
O12 Mo11 O13 85.25(12) . .
O9 Mo11 O13 74.01(12) . .
O36 Mo11 O13 80.70(12) . .
O29 Mo11 O13 72.22(11) . .
O28 Mo12 O24 103.86(15) . .
O28 Mo12 O26 101.58(15) . .
O24 Mo12 O26 96.12(14) . .
O28 Mo12 O35 98.81(15) . .
O24 Mo12 O35 155.76(13) . .
O26 Mo12 O35 87.54(14) . .
O28 Mo12 O12 101.37(15) . .
O24 Mo12 O12 85.27(13) . .
O26 Mo12 O12 155.96(13) . .
O35 Mo12 O12 81.94(13) . .
O28 Mo12 O16 170.38(13) . .
O24 Mo12 O16 85.30(12) . .
O26 Mo12 O16 74.15(12) . .
O35 Mo12 O16 72.63(11) . .
O12 Mo12 O16 82.07(11) . .
C18 N1 C16 121.0(5) . .
C2 N2 N5 104.7(4) . .
C2 N2 Ag4 141.0(3) . .
N5 N2 Ag4 114.3(3) . .
C13 N3 N7 104.6(4) . .
C13 N3 Ag2 140.1(3) . 1_455
N7 N3 Ag2 111.9(3) . 1_455
C8 N4 N6 103.3(4) . .
C8 N4 Ag2 115.7(3) . .
N6 N4 Ag2 141.0(4) . .
C1 N5 N2 106.4(4) . .
C1 N5 Ag1 124.0(3) . .
N2 N5 Ag1 128.1(3) . .
C9 N6 N4 108.2(5) . .
C12 N7 N3 106.5(4) . .
C12 N7 Ag3 124.6(3) . .
N3 N7 Ag3 128.8(3) . .
C12 N8 C13 101.5(4) . .
C12 N8 Ag4 103.5(3) . .
C13 N8 Ag4 152.4(3) . .
C5 N9 C6 122.8(5) . .
C10 N10 N11 109.2(4) . .
N10 N11 C11 102.9(4) . .
N10 N11 Ag4 141.9(3) . .
C11 N11 Ag4 114.8(3) . .
C1 N12 C2 102.4(4) . .
C1 N12 Ag2 105.6(3) . .
C2 N12 Ag2 152.0(3) . .
C8 N13 C9 102.5(4) . .
C11 N14 C10 102.8(4) . .
Mo6 O1 Mo7 122.53(15) . .
Mo6 O1 Ag4 112.25(14) . .
Mo7 O1 Ag4 122.33(14) . .
Mo5 O2 Mo6 125.48(16) . .
Mo5 O4 Mo4 149.76(18) . .
Mo3 O5 Mo4 125.42(16) . .
Mo2 O6 Mo3 123.70(17) . .
Mo2 O7 Mo1 152.05(18) . .
Mo9 O8 Mo8 125.76(16) . .
Mo1 O11 Mo9 151.63(18) . .
Mo11 O12 Mo12 149.82(18) . .
P1 O13 Mo9 125.30(17) . .
P1 O13 Mo11 126.25(16) . .
Mo9 O13 Mo11 89.50(10) . .
P1 O13 Mo8 126.52(16) . .
Mo9 O13 Mo8 88.72(10) . .
Mo11 O13 Mo8 88.54(10) . .
P1 O14 Mo2 125.25(16) . .
P1 O14 Mo3 126.60(16) . .
Mo2 O14 Mo3 88.84(10) . .
P1 O14 Mo4 126.15(16) . .
Mo2 O14 Mo4 88.87(10) . .
Mo3 O14 Mo4 89.15(10) . .
P1 O15 Mo7 125.49(17) . .
P1 O15 Mo6 126.45(17) . .
Mo7 O15 Mo6 89.59(10) . .
P1 O15 Mo5 124.91(16) . .
Mo7 O15 Mo5 89.30(10) . .
Mo6 O15 Mo5 89.60(10) . .
P1 O16 Mo12 125.65(17) . .
P1 O16 Mo10 126.01(17) . .
Mo12 O16 Mo10 89.25(10) . .
P1 O16 Mo1 126.77(16) . .
Mo12 O16 Mo1 88.48(10) . .
Mo10 O16 Mo1 88.53(10) . .
Mo6 O17 Mo10 152.82(18) . .
Mo7 O18 Mo5 125.35(16) . .
Mo4 O20 Mo2 125.39(16) . .
Mo9 O22 Mo2 153.36(18) . .
Mo12 O24 Mo7 152.40(18) . .
Mo12 O26 Mo10 125.28(16) . .
Mo8 O29 Mo11 124.57(16) . .
Mo10 O33 Mo1 126.50(16) . .
Mo10 O34 Mo3 153.20(18) . .
Mo1 O35 Mo12 125.31(16) . .
Mo7 O36 Mo11 152.39(18) . .
Mo8 O38 Mo5 152.47(18) . .
Mo3 O39 Mo6 150.36(18) . .
Mo4 O40 Mo8 154.63(18) . .
O16 P1 O15 109.92(17) . .
O16 P1 O13 109.49(17) . .
O15 P1 O13 109.42(18) . .
O16 P1 O14 109.26(17) . .
O15 P1 O14 108.90(17) . .
O13 P1 O14 109.84(17) . .
Mo11 O9 Mo9 124.46(16) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 N5 1.329(6) .
C1 N12 1.332(6) .
C1 C8 1.453(7) .
C2 N2 1.339(6) .
C2 N12 1.351(6) .
C2 C3 1.464(6) .
C3 C7 1.388(7) .
C3 C4 1.391(7) .
C4 C5 1.365(7) .
C5 N9 1.327(8) .
C6 N9 1.339(8) .
C6 C7 1.380(8) .
C8 N13 1.323(6) .
C8 N4 1.350(6) .
C9 N6 1.332(7) .
C9 N13 1.340(6) .
C10 N10 1.326(6) .
C10 N14 1.352(6) .
C11 N14 1.325(6) .
C11 N11 1.363(6) .
C11 C12 1.455(6) .
C12 N7 1.326(6) .
C12 N8 1.343(6) .
C13 N3 1.342(6) .
C13 N8 1.347(6) .
C13 C14 1.473(6) .
C14 C15 1.379(7) .
C14 C17 1.382(7) .
C15 C16 1.360(7) .
C16 N1 1.341(7) .
C17 C18 1.383(7) .
C18 N1 1.327(7) .
Ag1 N5 2.090(4) .
Ag1 N5 2.090(4) 2_554
Ag2 N3 2.236(4) 1_655
Ag2 N4 2.283(4) .
Ag2 N12 2.582(4) .
Ag3 N7 2.108(4) .
Ag3 N7 2.108(4) 2_454
Ag4 N2 2.213(4) .
Ag4 N11 2.249(4) .
Ag4 O1 2.543(3) .
Ag4 N8 2.614(4) .
Mo1 O10 1.687(3) .
Mo1 O35 1.835(3) .
Mo1 O11 1.844(3) .
Mo1 O7 1.991(3) .
Mo1 O33 2.005(3) .
Mo1 O16 2.481(3) .
Mo2 O32 1.683(3) .
Mo2 O7 1.835(3) .
Mo2 O6 1.840(3) .
Mo2 O22 1.981(3) .
Mo2 O20 2.007(3) .
Mo2 O14 2.412(3) .
Mo3 O30 1.685(3) .
Mo3 O5 1.829(3) .
Mo3 O39 1.844(3) .
Mo3 O6 1.990(3) .
Mo3 O34 2.004(3) .
Mo3 O14 2.414(3) .
Mo4 O23 1.680(3) .
Mo4 O40 1.812(3) .
Mo4 O20 1.841(3) .
Mo4 O4 2.014(3) .
Mo4 O5 2.028(3) .
Mo4 O14 2.472(3) .
Mo5 O3 1.677(3) .
Mo5 O4 1.837(3) .
Mo5 O2 1.870(3) .
Mo5 O38 1.967(3) .
Mo5 O18 2.028(3) .
Mo5 O15 2.452(3) .
Mo6 O37 1.677(3) .
Mo6 O17 1.828(3) .
Mo6 O1 1.874(3) .
Mo6 O2 1.997(3) .
Mo6 O39 2.005(3) .
Mo6 O15 2.427(3) .
Mo7 O19 1.677(3) .
Mo7 O18 1.830(3) .
Mo7 O36 1.831(3) .
Mo7 O24 2.008(3) .
Mo7 O1 2.026(3) .
Mo7 O15 2.427(3) .
Mo8 O21 1.683(3) .
Mo8 O29 1.841(3) .
Mo8 O38 1.856(3) .
Mo8 O8 1.970(3) .
Mo8 O40 2.010(3) .
Mo8 O13 2.449(3) .
Mo9 O31 1.677(3) .
Mo9 O22 1.831(3) .
Mo9 O8 1.865(3) .
Mo9 O11 2.002(3) .
Mo9 O9 2.004(3) .
Mo9 O13 2.433(3) .
Mo10 O25 1.690(3) .
Mo10 O34 1.836(3) .
Mo10 O33 1.843(3) .
Mo10 O26 1.987(3) .
Mo10 O17 2.026(3) .
Mo10 O16 2.444(3) .
Mo11 O27 1.676(3) .
Mo11 O12 1.832(3) .
Mo11 O9 1.870(3) .
Mo11 O36 1.968(3) .
Mo11 O29 2.012(3) .
Mo11 O13 2.437(3) .
Mo12 O28 1.669(3) .
Mo12 O24 1.837(3) .
Mo12 O26 1.850(3) .
Mo12 O35 2.004(3) .
Mo12 O12 2.019(3) .
Mo12 O16 2.409(3) .
N2 N5 1.375(5) .
N3 N7 1.367(5) .
N3 Ag2 2.236(4) 1_455
N4 N6 1.350(6) .
N10 N11 1.349(6) .
O13 P1 1.535(3) .
O14 P1 1.536(3) .
O15 P1 1.534(3) .
O16 P1 1.531(3) .
