#------------------------------------------------------------------------------
#$Date: 2022-09-21 18:44:46 +0300 (Wed, 21 Sep 2022) $
#$Revision: 278046 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/21/01/7210190.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_7210190
loop_
_publ_author_name
'Ainscough, Eric W.'
'Brodie, Andrew M.'
'Davidson, Ross J.'
'Jameson, Geoffrey B.'
'Otter, Carl A.'
_publ_section_title
;
 Flexible pyridyloxy-substituted cyclotetraphosphazene platforms linked by
 silver(i)
;
_journal_issue                   21
_journal_name_full               CrystEngComm
_journal_page_first              4379
_journal_paper_doi               10.1039/c3ce40395e
_journal_volume                  15
_journal_year                    2013
_chemical_formula_moiety         'C20 H16 Ag N6 O4 P2, F6 P'
_chemical_formula_sum            'C40 H32 Ag2 F12 N12 O8 P6'
_chemical_formula_weight         1438.34
_chemical_name_systematic
;
?
;
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_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                 90.70(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   24.990(5)
_cell_length_b                   14.430(3)
_cell_length_c                   15.590(3)
_cell_measurement_temperature    85(2)
_cell_volume                     5621.4(19)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      85(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'CCD area detector'
_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     0.71073
_diffrn_reflns_av_R_equivalents  0.0687
_diffrn_reflns_av_sigmaI/netI    0.1037
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_h_min       -30
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       10
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            14768
_diffrn_reflns_theta_full        25.35
_diffrn_reflns_theta_max         25.35
_diffrn_reflns_theta_min         2.82
_exptl_absorpt_coefficient_mu    0.966
_exptl_absorpt_correction_T_max  1
_exptl_absorpt_correction_T_min  0.504602
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.700
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             2848
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.12
_platon_squeeze_details
;
PF6- molecules disordered over several sites and orientations were
found in the unit cell.
The contributions from these were removed using Platon / SQUEEZE.
46.1 electrons / cell were removed (0.66 PF6- = 46e-)
and 184.0 A3 was left by the void.
;
_refine_diff_density_max         0.682
_refine_diff_density_min         -0.785
_refine_diff_density_rms         0.097
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.042
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     538
_refine_ls_number_reflns         5125
_refine_ls_number_restraints     909
_refine_ls_restrained_S_all      1.055
_refine_ls_R_factor_all          0.1566
_refine_ls_R_factor_gt           0.0721
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0923P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1638
_refine_ls_wR_factor_ref         0.1988
_reflns_number_gt                2456
_reflns_number_total             5125
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3ce40395e.txt
_cod_data_source_block           2agtet_best
_cod_original_sg_symbol_Hall     '-C 2yc '
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               7210190
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
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 1.08776(3) 0.12828(5) 0.06165(5) 0.0783(4) Uani 1 1 d . . .
P1 P 0.9618(4) -0.0474(5) 0.1733(7) 0.064(3) Uani 0.50 1 d PDU . .
P2 P 0.94029(18) 0.1477(3) 0.1858(3) 0.0376(12) Uani 0.50 1 d PDU . .
N1 N 0.9279(5) 0.0412(6) 0.1747(10) 0.045(3) Uani 0.50 1 d PDU . .
N2 N 0.9772(3) 0.1765(7) 0.2624(7) 0.040(3) Uani 0.50 1 d PDU . .
N4 N 1.0000 -0.0809(6) 0.2500 0.067(2) Uani 1 2 d SDU . .
P4 P 1.0257(4) -0.0347(5) 0.3279(7) 0.054(2) Uani 0.50 1 d PDU . .
P3 P 1.03297(18) 0.1548(3) 0.2995(4) 0.0410(14) Uani 0.50 1 d PDU . .
N3 N 1.0561(5) 0.0587(6) 0.3143(11) 0.057(3) Uani 0.50 1 d PDU . .
N21 N 1.0935(3) -0.0266(5) 0.0552(4) 0.0593(17) Uani 1 1 d U B .
O2 O 1.0070(2) -0.0293(4) 0.0934(3) 0.0616(15) Uani 1 1 d U . .
C15 C 0.8019(4) -0.1621(8) 0.0681(7) 0.094(3) Uani 1 1 d U . .
H15 H 0.7856 -0.1794 0.0166 0.113 Uiso 1 1 calc R . .
N11 N 0.8547(3) -0.1522(5) 0.0704(6) 0.075(2) Uani 1 1 d U . .
O1 O 0.9305(3) -0.1220(4) 0.1403(5) 0.095(2) Uani 1 1 d U . .
C23 C 1.1056(4) -0.2173(7) 0.0734(6) 0.076(2) Uani 1 1 d U . .
H23 H 1.1095 -0.2811 0.0792 0.091 Uiso 1 1 calc R . .
C11 C 0.8758(4) -0.1273(6) 0.1422(8) 0.075(2) Uani 1 1 d U . .
C13 C 0.7944(4) -0.1199(6) 0.2148(6) 0.075(2) Uani 1 1 d U . .
H13 H 0.7745 -0.1078 0.2636 0.089 Uiso 1 1 calc R . .
C12 C 0.8485(4) -0.1102(6) 0.2170(6) 0.073(2) Uani 1 1 d U . .
H12 H 0.8665 -0.0926 0.2670 0.088 Uiso 1 1 calc R . .
C24 C 1.1474(4) -0.1639(7) 0.0463(6) 0.072(2) Uani 1 1 d U B .
H24 H 1.1803 -0.1907 0.0341 0.087 Uiso 1 1 calc R . .
C22 C 1.0560(4) -0.1736(7) 0.0924(6) 0.072(2) Uani 1 1 d U B .
H22 H 1.0269 -0.2069 0.1125 0.087 Uiso 1 1 calc R . .
O3 O 0.8870(3) 0.2093(6) 0.1933(6) 0.040(2) Uani 0.50 1 d PDU . 1
N31 N 0.8404(5) 0.1394(11) 0.3024(8) 0.039(3) Uani 0.50 1 d PDU A 1
C35 C 0.7921(6) 0.1092(12) 0.3274(9) 0.046(4) Uani 0.50 1 d PDU A 1
H35 H 0.7904 0.0812 0.3811 0.056 Uiso 0.50 1 calc PR A 1
C34 C 0.7444(6) 0.1157(11) 0.2808(10) 0.046(3) Uani 0.50 1 d PDU A 1
H34 H 0.7123 0.0934 0.3021 0.056 Uiso 0.50 1 calc PR A 1
C33 C 0.7474(6) 0.1565(11) 0.2020(9) 0.050(3) Uani 0.50 1 d PDU A 1
H33 H 0.7171 0.1596 0.1668 0.060 Uiso 0.50 1 calc PR A 1
C32 C 0.7931(7) 0.1916(14) 0.1755(13) 0.046(4) Uani 0.50 1 d PDU A 1
H32 H 0.7942 0.2249 0.1245 0.055 Uiso 0.50 1 calc PR A 1
C31 C 0.8409(7) 0.1782(11) 0.2252(10) 0.039(3) Uani 0.50 1 d PDU A 1
O5 O 1.0772(3) 0.2105(6) 0.2475(6) 0.040(2) Uani 0.50 1 d PDU . 2
N51 N 1.1450(5) 0.1443(11) 0.1736(9) 0.050(4) Uani 0.50 1 d PDU B 2
C55 C 1.1963(6) 0.1191(15) 0.1730(11) 0.059(4) Uani 0.50 1 d PDU B 2
H55 H 1.2093 0.0937 0.1225 0.070 Uiso 0.50 1 calc PR B 2
C51 C 1.1288(6) 0.1844(9) 0.2461(10) 0.043(3) Uani 0.50 1 d PDU . 2
C52 C 1.1638(6) 0.2008(11) 0.3163(10) 0.045(3) Uani 0.50 1 d PDU B 2
H52 H 1.1519 0.2333 0.3639 0.054 Uiso 0.50 1 calc PR B 2
C53 C 1.2142(8) 0.1692(14) 0.3141(14) 0.049(4) Uani 0.50 1 d PDU B 2
H53 H 1.2369 0.1754 0.3616 0.059 Uiso 0.50 1 calc PR B 2
C54 C 1.2316(7) 0.1279(12) 0.2412(10) 0.053(4) Uani 0.50 1 d PDU B 2
H54 H 1.2665 0.1062 0.2373 0.063 Uiso 0.50 1 calc PR B 2
C14 C 0.7691(5) -0.1477(7) 0.1405(7) 0.091(3) Uani 1 1 d U . .
H14 H 0.7323 -0.1565 0.1378 0.110 Uiso 1 1 calc R . .
C25 C 1.1400(4) -0.0717(6) 0.0375(5) 0.066(2) Uani 1 1 d U . .
H25 H 1.1686 -0.0366 0.0179 0.080 Uiso 1 1 calc R B .
C21 C 1.0536(4) -0.0812(7) 0.0798(5) 0.062(2) Uani 1 1 d U . .
O4A O 0.9662(6) 0.2073(8) 0.1100(8) 0.037(2) Uani 0.50 1 d PDU . 1
N41A N 1.0461(6) 0.2752(9) 0.0717(11) 0.044(3) Uani 0.50 1 d PDU B 1
C41A C 0.9985(6) 0.2859(9) 0.1076(10) 0.043(2) Uani 0.50 1 d PDU B 1
C45A C 1.0777(6) 0.3521(10) 0.0676(11) 0.052(3) Uani 0.50 1 d PDU B 1
H45A H 1.1110 0.3467 0.0421 0.062 Uiso 0.50 1 calc PR B 1
C42A C 0.9802(5) 0.3665(10) 0.1386(9) 0.054(3) Uani 0.50 1 d PDU B 1
H42A H 0.9464 0.3702 0.1629 0.064 Uiso 0.50 1 calc PR B 1
C43A C 1.0117(6) 0.4420(10) 0.1338(10) 0.063(3) Uani 0.50 1 d PDU B 1
H43A H 0.9995 0.4989 0.1537 0.076 Uiso 0.50 1 calc PR B 1
C44A C 1.0634(6) 0.4348(11) 0.0984(12) 0.062(3) Uani 0.50 1 d PDU B 1
H44A H 1.0865 0.4854 0.0966 0.075 Uiso 0.50 1 calc PR B 1
O4B O 0.9650(7) 0.1789(8) 0.0967(8) 0.039(3) Uani 0.50 1 d PDU . 2
C45B C 1.0681(5) 0.3321(10) 0.0325(10) 0.047(3) Uani 0.50 1 d PDU B 2
H45B H 1.1026 0.3263 0.0113 0.056 Uiso 0.50 1 calc PR B 2
C41B C 0.9917(6) 0.2635(9) 0.0821(9) 0.043(3) Uani 0.50 1 d PDU B 2
N41B N 1.0409(6) 0.2522(9) 0.0527(11) 0.045(3) Uani 0.50 1 d PDU B 2
C42B C 0.9683(5) 0.3469(10) 0.0919(9) 0.052(3) Uani 0.50 1 d PDU B 2
H42B H 0.9335 0.3505 0.1123 0.063 Uiso 0.50 1 calc PR B 2
C43B C 0.9951(6) 0.4251(10) 0.0724(10) 0.060(3) Uani 0.50 1 d PDU B 2
H43B H 0.9791 0.4828 0.0791 0.072 Uiso 0.50 1 calc PR B 2
C44B C 1.0481(6) 0.4175(11) 0.0413(12) 0.059(3) Uani 0.50 1 d PDU B 2
H44B H 1.0681 0.4698 0.0277 0.071 Uiso 0.50 1 calc PR B 2
P90 P 0.31062(9) 0.05368(18) 0.52641(16) 0.0653(7) Uani 1 1 d DU . .
F1 F 0.3318(6) -0.0441(7) 0.5402(8) 0.166(7) Uani 0.835(18) 1 d PU C 1
F2 F 0.3371(3) 0.0577(4) 0.4350(4) 0.114(2) Uani 1 1 d U C 1
F3 F 0.3629(3) 0.1019(10) 0.5673(6) 0.134(5) Uani 0.835(18) 1 d PU C 1
F4 F 0.2844(2) 0.0519(4) 0.6174(4) 0.110(2) Uani 1 1 d U C 1
F5 F 0.2563(4) 0.0221(8) 0.4828(7) 0.125(4) Uani 0.835(18) 1 d PU C 1
F6 F 0.2906(4) 0.1585(4) 0.5103(5) 0.080(3) Uani 0.835(18) 1 d PU C 1
F4A F 0.3693(9) 0.027(2) 0.550(3) 0.079(9) Uani 0.165(18) 1 d PDU C 2
F6A F 0.2996(13) -0.0538(16) 0.516(3) 0.079(9) Uani 0.165(18) 1 d PDU C 2
F3A F 0.3224(12) 0.1554(16) 0.539(3) 0.079(9) Uani 0.165(18) 1 d PDU C 2
F5A F 0.2516(9) 0.071(2) 0.506(3) 0.079(9) Uani 0.165(18) 1 d PDU C 2
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'
F F 0.0171 0.0103 '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'
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_3
N41B Ag1 N21 149.9(4) .
N41B Ag1 N51 107.8(6) .
N21 Ag1 N51 95.5(4) .
N41B Ag1 N41A 10.3(7) .
N21 Ag1 N41A 157.5(4) .
N51 Ag1 N41A 97.6(6) .
N41B Ag1 N11 98.5(4) 5_755
N21 Ag1 N11 93.5(2) 5_755
N51 Ag1 N11 104.6(4) 5_755
N41A Ag1 N11 100.7(4) 5_755
O1 P1 N1 109.5(8) .
O1 P1 N4 111.4(7) .
N1 P1 N4 124.6(9) .
O1 P1 O2 102.5(7) .
N1 P1 O2 104.5(8) .
N4 P1 O2 101.4(6) .
N2 P2 N1 117.3(7) .
N2 P2 O4B 111.2(8) .
N1 P2 O4B 105.0(8) .
N2 P2 O3 106.2(6) .
N1 P2 O3 112.7(6) .
O4B P2 O3 103.8(7) .
N2 P2 O4A 100.4(8) .
N1 P2 O4A 121.5(8) .
O3 P2 O4A 95.7(7) .
P1 N1 P2 134.9(8) .
P3 N2 P2 139.6(7) .
P4 N4 P1 135.1(6) .
N4 P4 N3 118.0(8) .
N3 P3 N2 125.9(7) .
N3 P3 O5 105.7(7) .
N2 P3 O5 109.7(6) .
P3 N3 P4 128.4(9) .
C21 N21 C25 114.8(8) .
C21 N21 Ag1 121.9(5) .
C25 N21 Ag1 122.7(6) .
C21 O2 P1 125.7(6) .
N11 C15 C14 123.1(11) .
N11 C15 H15 118.5 .
C14 C15 H15 118.5 .
C11 N11 C15 116.8(9) .
C11 N11 Ag1 115.9(6) 5_755
C15 N11 Ag1 124.3(7) 5_755
C11 O1 P1 125.4(7) .
C24 C23 C22 118.9(9) .
C24 C23 H23 120.5 .
C22 C23 H23 120.5 .
N11 C11 C12 125.9(10) .
N11 C11 O1 113.3(8) .
C12 C11 O1 120.7(11) .
C12 C13 C14 119.9(9) .
C12 C13 H13 120.0 .
C14 C13 H13 120.0 .
C13 C12 C11 117.4(10) .
C13 C12 H12 121.3 .
C11 C12 H12 121.3 .
C25 C24 C23 118.8(9) .
C25 C24 H24 120.6 .
C23 C24 H24 120.6 .
C21 C22 C23 116.5(9) .
C21 C22 H22 121.8 .
C23 C22 H22 121.8 .
C31 O3 P2 124.1(9) .
C31 N31 C35 114.6(13) .
N31 C35 C34 126.3(13) .
N31 C35 H35 116.8 .
C34 C35 H35 116.8 .
C33 C34 C35 116.3(14) .
C33 C34 H34 121.8 .
C35 C34 H34 121.8 .
C32 C33 C34 120.3(17) .
C32 C33 H33 119.9 .
C34 C33 H33 119.9 .
C33 C32 C31 119.9(16) .
C33 C32 H32 120.0 .
C31 C32 H32 120.0 .
N31 C31 O3 119.6(15) .
N31 C31 C32 122.2(14) .
O3 C31 C32 118.2(12) .
C51 O5 P3 122.5(8) .
C55 N51 C51 115.1(13) .
C55 N51 Ag1 124.5(9) .
C51 N51 Ag1 120.3(10) .
N51 C55 C54 125.2(14) .
N51 C55 H55 117.4 .
C54 C55 H55 117.4 .
N51 C51 O5 115.7(14) .
N51 C51 C52 122.6(14) .
O5 C51 C52 121.7(12) .
C53 C52 C51 119.8(16) .
C53 C52 H52 120.1 .
C51 C52 H52 120.1 .
C54 C53 C52 118.7(17) .
C54 C53 H53 120.7 .
C52 C53 H53 120.7 .
C53 C54 C55 118.4(15) .
C53 C54 H54 120.8 .
C55 C54 H54 120.8 .
C13 C14 C15 116.8(11) .
C13 C14 H14 121.6 .
C15 C14 H14 121.6 .
C24 C25 N21 124.5(9) .
C24 C25 H25 117.7 .
N21 C25 H25 117.7 .
N21 C21 C22 126.4(8) .
N21 C21 O2 110.7(8) .
C22 C21 O2 122.9(9) .
C41A O4A P2 134.1(11) .
C41A N41A C45A 116.5(11) .
C41A N41A Ag1 121.9(9) .
C45A N41A Ag1 118.0(10) .
N41A C41A C42A 124.2(11) .
N41A C41A O4A 116.0(13) .
C42A C41A O4A 119.7(12) .
C44A C45A N41A 123.5(11) .
C44A C45A H45A 118.2 .
N41A C45A H45A 118.2 .
C41A C42A C43A 118.6(12) .
C41A C42A H42A 120.7 .
C43A C42A H42A 120.7 .
C42A C43A C44A 120.0(13) .
C42A C43A H43A 120.0 .
C44A C43A H43A 120.0 .
C45A C44A C43A 117.1(13) .
C45A C44A H44A 121.5 .
C43A C44A H44A 121.5 .
C41B O4B P2 125.1(10) .
C44B C45B N41B 124.1(11) .
C44B C45B H45B 117.9 .
N41B C45B H45B 117.9 .
N41B C41B C42B 123.7(11) .
N41B C41B O4B 113.0(12) .
C42B C41B O4B 123.2(12) .
C41B N41B C45B 116.0(11) .
C41B N41B Ag1 126.1(10) .
C45B N41B Ag1 116.3(10) .
C43B C42B C41B 120.3(12) .
C43B C42B H42B 119.8 .
C41B C42B H42B 119.8 .
C42B C43B C44B 118.7(12) .
C42B C43B H43B 120.7 .
C44B C43B H43B 120.7 .
C45B C44B C43B 117.2(12) .
C45B C44B H44B 121.4 .
C43B C44B H44B 121.4 .
F3A P90 F1 144.7(11) .
F3A P90 F5A 93.1(8) .
F1 P90 F5A 121.0(10) .
F3A P90 F4A 91.5(8) .
F1 P90 F4A 54.1(9) .
F5A P90 F4A 175.0(13) .
F3A P90 F4 88.9(15) .
F1 P90 F4 90.3(4) .
F5A P90 F4 77.2(17) .
F4A P90 F4 100.9(16) .
F3A P90 F5 120.2(12) .
F1 P90 F5 95.1(7) .
F4A P90 F5 146.5(11) .
F4 P90 F5 91.0(5) .
F3A P90 F2 89.9(15) .
F1 P90 F2 90.7(4) .
F5A P90 F2 102.7(17) .
F4A P90 F2 79.3(16) .
F4 P90 F2 178.8(4) .
F5 P90 F2 89.4(5) .
F3A P90 F6A 177.9(17) .
F5A P90 F6A 88.5(8) .
F4A P90 F6A 86.9(8) .
F4 P90 F6A 90.0(17) .
F5 P90 F6A 61.7(10) .
F2 P90 F6A 91.1(17) .
F3A P90 F3 50.9(11) .
F1 P90 F3 93.8(7) .
F5A P90 F3 142.3(11) .
F4 P90 F3 89.8(4) .
F5 P90 F3 171.1(6) .
F2 P90 F3 89.7(4) .
F6A P90 F3 127.2(9) .
F1 P90 F6 177.6(5) .
F5A P90 F6 61.1(11) .
F4A P90 F6 123.8(11) .
F4 P90 F6 91.4(4) .
F5 P90 F6 86.6(5) .
F2 P90 F6 87.6(3) .
F6A P90 F6 148.3(10) .
F3 P90 F6 84.5(5) .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N41B 2.141(13) .
Ag1 N21 2.242(7) .
Ag1 N51 2.255(14) .
Ag1 N41A 2.367(13) .
Ag1 N11 2.549(7) 5_755
P1 O1 1.423(10) .
P1 N1 1.535(10) .
P1 N4 1.595(10) .
P1 O2 1.712(14) .
P2 N2 1.557(9) .
P2 N1 1.576(9) .
P2 O4B 1.592(11) .
P2 O3 1.606(9) .
P2 O4A 1.604(11) .
N2 P3 1.534(9) .
N4 P4 1.521(10) .
P4 N3 1.564(10) .
P3 N3 1.519(10) .
P3 O5 1.597(9) .
N21 C21 1.333(11) .
N21 C25 1.362(10) .
O2 C21 1.403(9) .
C15 N11 1.328(12) .
C15 C14 1.417(13) .
C15 H15 0.9300 .
N11 C11 1.282(12) .
N11 Ag1 2.549(7) 5_755
O1 C11 1.370(11) .
C23 C24 1.368(12) .
C23 C22 1.426(12) .
C23 H23 0.9300 .
C11 C12 1.379(12) .
C13 C12 1.361(13) .
C13 C14 1.371(14) .
C13 H13 0.9300 .
C12 H12 0.9300 .
C24 C25 1.351(12) .
C24 H24 0.9300 .
C22 C21 1.348(12) .
C22 H22 0.9300 .
O3 C31 1.339(15) .
N31 C31 1.329(15) .
N31 C35 1.347(14) .
C35 C34 1.390(16) .
C35 H35 0.9300 .
C34 C33 1.366(18) .
C34 H34 0.9300 .
C33 C32 1.32(2) .
C33 H33 0.9300 .
C32 C31 1.43(2) .
C32 H32 0.9300 .
O5 C51 1.344(15) .
N51 C55 1.333(15) .
N51 C51 1.336(15) .
C55 C54 1.380(17) .
C55 H55 0.9300 .
C51 C52 1.41(2) .
C52 C53 1.34(2) .
C52 H52 0.9300 .
C53 C54 1.360(19) .
C53 H53 0.9300 .
C54 H54 0.9300 .
C14 H14 0.9300 .
C25 H25 0.9300 .
O4A C41A 1.393(13) .
N41A C41A 1.331(16) .
N41A C45A 1.364(15) .
C41A C42A 1.342(15) .
C45A C44A 1.337(17) .
C45A H45A 0.9300 .
C42A C43A 1.348(16) .
C42A H42A 0.9300 .
C43A C44A 1.415(16) .
C43A H43A 0.9300 .
C44A H44A 0.9300 .
O4B C41B 1.411(13) .
C45B C44B 1.338(17) .
C45B N41B 1.377(15) .
C45B H45B 0.9300 .
C41B N41B 1.327(16) .
C41B C42B 1.347(15) .
C42B C43B 1.348(16) .
C42B H42B 0.9300 .
C43B C44B 1.422(16) .
C43B H43B 0.9300 .
C44B H44B 0.9300 .
P90 F3A 1.51(2) .
P90 F1 1.522(7) .
P90 F5A 1.53(2) .
P90 F4A 1.55(2) .
P90 F4 1.570(6) .
P90 F5 1.577(9) .
P90 F2 1.580(6) .
P90 F6A 1.58(2) .
P90 F3 1.604(9) .
P90 F6 1.611(7) .
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
1 0.500 -0.085 0.250 184.1 46.2
2 0.500 0.084 0.750 184.0 46.1
3 1.000 0.415 0.250 184.1 46.2
4 0.000 0.584 0.750 184.0 46.1
