#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/09/7010912.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_7010912
loop_
_publ_author_name
'Wilton-Ely, James D. E. T.'
'Schier, Annette'
'Schmidbaur, Hubert'
_publ_section_title
;
 Silver(i) coordination by variants of the bis(diphenylphosphino)amine
 chalcogenide ligandElectronic supplementary information (ESI)
 available: tables of crystal data. See
 http://www.rsc.org/suppdata/dt/b1/b105154g/
;
_journal_issue                   24
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              3647
_journal_paper_doi               10.1039/b105154g
_journal_year                    2001
_chemical_formula_sum            'C51 H51 Ag Br N2 O1.5 P4 Se2'
_chemical_formula_weight         1185.52
_chemical_name_systematic
; 
? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   'geom (CH), difmap (NH, OH)'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                102.491(1)
_cell_angle_beta                 98.362(1)
_cell_angle_gamma                92.744(1)
_cell_formula_units_Z            4
_cell_length_a                   10.3900(1)
_cell_length_b                   17.3447(3)
_cell_length_c                   29.5465(5)
_cell_measurement_reflns_used    116262
_cell_measurement_temperature    293(2)
_cell_volume                     5125.94(14)
_computing_cell_refinement       SCALEPACK
_computing_data_collection       XPRESS
_computing_data_reduction        DENZO
_computing_molecular_graphics    SHELXTL-PLUS
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.853
_diffrn_measured_fraction_theta_max 0.853
_diffrn_measurement_device_type  'NONIUS DIP 2020'
_diffrn_measurement_method       phi-rotation
_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  0.044
_diffrn_reflns_av_sigmaI/netI    0.038
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            116262
_diffrn_reflns_theta_full        27.09
_diffrn_reflns_theta_max         27.09
_diffrn_reflns_theta_min         3.13
_exptl_absorpt_coefficient_mu    2.757
_exptl_absorpt_correction_type   none
_exptl_crystal_density_diffrn    1.536
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2372
_exptl_crystal_size_max          0.60
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.234
_refine_diff_density_min         -0.962
_refine_diff_density_rms         0.087
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_hydrogen_treatment    'riding (CH), isotropical (NH), Uisofix (OH)'
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1136
_refine_ls_number_reflns         19290
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.027
_refine_ls_R_factor_all          0.0529
_refine_ls_R_factor_gt           0.0408
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0274P)²+12.2799P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0857
_refine_ls_wR_factor_ref         0.0906
_reflns_number_gt                15979
_reflns_number_total             19290
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b105154g.txt
_cod_data_source_block           jam23
_cod_original_cell_volume        5125.94(13)
_cod_original_sg_symbol_H-M      P-1
_cod_original_formula_sum        'C51 H51 Ag Br N2 O1.50 P4 Se2'
_cod_database_code               7010912
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.73212(3) 0.697297(16) 0.492071(9) 0.02123(6) Uani 1 1 d . . .
Se11 Se 0.98827(4) 0.75363(2) 0.534692(13) 0.02606(9) Uani 1 1 d . . .
Se12 Se 0.72250(4) 0.55854(2) 0.428533(12) 0.02191(8) Uani 1 1 d . . .
P11 P 0.89772(9) 0.79094(5) 0.59502(3) 0.02093(19) Uani 1 1 d . . .
P12 P 0.69821(9) 0.66095(5) 0.56621(3) 0.01817(18) Uani 1 1 d . . .
P13 P 0.60797(9) 0.75904(5) 0.43457(3) 0.01777(18) Uani 1 1 d . . .
P14 P 0.66086(8) 0.61227(5) 0.37172(3) 0.01722(18) Uani 1 1 d . . .
N11 N 0.8136(3) 0.71815(19) 0.60860(11) 0.0220(7) Uani 1 1 d . . .
N12 N 0.5638(3) 0.68539(18) 0.38503(10) 0.0189(6) Uani 1 1 d . . .
Br1 Br 0.36676(4) 0.72402(3) 0.289925(13) 0.03392(10) Uani 1 1 d . . .
C1 C 1.0108(4) 0.8337(2) 0.64824(14) 0.0273(8) Uani 1 1 d . . .
C2 C 0.9633(4) 0.8541(3) 0.69081(15) 0.0362(10) Uani 1 1 d . . .
H2A H 0.8748 0.8454 0.6916 0.043 Uiso 1 1 calc R . .
C3 C 1.0486(5) 0.8873(3) 0.73169(17) 0.0471(12) Uani 1 1 d . . .
H3A H 1.0178 0.9002 0.7602 0.057 Uiso 1 1 calc R . .
C4 C 1.1794(5) 0.9013(3) 0.73009(16) 0.0434(12) Uani 1 1 d . . .
H4A H 1.2362 0.9242 0.7576 0.052 Uiso 1 1 calc R . .
C5 C 1.2270(5) 0.8818(3) 0.68850(17) 0.0423(11) Uani 1 1 d . . .
H5A H 1.3154 0.8916 0.6879 0.051 Uiso 1 1 calc R . .
C6 C 1.1421(4) 0.8471(2) 0.64706(15) 0.0322(9) Uani 1 1 d . . .
H6A H 1.1740 0.8331 0.6188 0.039 Uiso 1 1 calc R . .
C7 C 0.7850(4) 0.8652(2) 0.58603(14) 0.0291(9) Uani 1 1 d . . .
C8 C 0.6820(4) 0.8763(3) 0.61079(15) 0.0356(10) Uani 1 1 d . . .
H8A H 0.6691 0.8454 0.6321 0.043 Uiso 1 1 calc R . .
C9 C 0.5976(5) 0.9339(3) 0.60360(19) 0.0508(13) Uani 1 1 d . . .
H9A H 0.5280 0.9416 0.6202 0.061 Uiso 1 1 calc R . .
C10 C 0.6169(6) 0.9799(3) 0.5717(2) 0.0592(16) Uani 1 1 d . . .
H10A H 0.5604 1.0185 0.5672 0.071 Uiso 1 1 calc R . .
C11 C 0.7185(6) 0.9688(3) 0.5470(2) 0.0564(15) Uani 1 1 d . . .
H11A H 0.7301 0.9993 0.5254 0.068 Uiso 1 1 calc R . .
C12 C 0.8045(5) 0.9119(2) 0.55409(17) 0.0385(10) Uani 1 1 d . . .
H12A H 0.8746 0.9049 0.5377 0.046 Uiso 1 1 calc R . .
C13 C 0.7401(3) 0.5596(2) 0.56321(11) 0.0196(7) Uani 1 1 d . . .
C14 C 0.8592(4) 0.5384(2) 0.54948(13) 0.0241(8) Uani 1 1 d . . .
H14A H 0.9175 0.5771 0.5446 0.029 Uiso 1 1 calc R . .
C15 C 0.8913(4) 0.4611(2) 0.54306(14) 0.0291(9) Uani 1 1 d . . .
H15A H 0.9714 0.4480 0.5344 0.035 Uiso 1 1 calc R . .
C16 C 0.8040(4) 0.4027(2) 0.54958(14) 0.0304(9) Uani 1 1 d . . .
H16A H 0.8254 0.3504 0.5452 0.037 Uiso 1 1 calc R . .
C17 C 0.6852(4) 0.4228(2) 0.56256(14) 0.0314(9) Uani 1 1 d . . .
H17A H 0.6265 0.3837 0.5668 0.038 Uiso 1 1 calc R . .
C18 C 0.6527(4) 0.5009(2) 0.56934(13) 0.0252(8) Uani 1 1 d . . .
H18A H 0.5726 0.5138 0.5780 0.030 Uiso 1 1 calc R . .
C19 C 0.5490(3) 0.6678(2) 0.59125(13) 0.0217(7) Uani 1 1 d . . .
C20 C 0.4324(4) 0.6601(3) 0.56072(15) 0.0336(9) Uani 1 1 d . . .
H20A H 0.4328 0.6515 0.5286 0.040 Uiso 1 1 calc R . .
C21 C 0.3152(4) 0.6651(3) 0.57781(19) 0.0438(11) Uani 1 1 d . . .
H21A H 0.2369 0.6590 0.5572 0.053 Uiso 1 1 calc R . .
C22 C 0.3148(5) 0.6791(3) 0.62551(19) 0.0428(11) Uani 1 1 d . . .
H22A H 0.2361 0.6835 0.6370 0.051 Uiso 1 1 calc R . .
C23 C 0.4301(5) 0.6865(3) 0.65619(17) 0.0447(12) Uani 1 1 d . . .
H23A H 0.4291 0.6956 0.6883 0.054 Uiso 1 1 calc R . .
C24 C 0.5473(4) 0.6804(3) 0.63929(14) 0.0339(9) Uani 1 1 d . . .
H24A H 0.6251 0.6847 0.6600 0.041 Uiso 1 1 calc R . .
C25 C 0.6872(3) 0.8395(2) 0.41490(12) 0.0210(7) Uani 1 1 d . . .
C26 C 0.6221(4) 0.8810(2) 0.38413(13) 0.0268(8) Uani 1 1 d . . .
H26A H 0.5330 0.8696 0.3736 0.032 Uiso 1 1 calc R . .
C27 C 0.6901(4) 0.9391(2) 0.36920(15) 0.0324(9) Uani 1 1 d . . .
H27A H 0.6466 0.9663 0.3485 0.039 Uiso 1 1 calc R . .
C28 C 0.8220(4) 0.9568(3) 0.38494(17) 0.0375(10) Uani 1 1 d . . .
H28A H 0.8671 0.9965 0.3754 0.045 Uiso 1 1 calc R . .
C29 C 0.8868(4) 0.9152(3) 0.41494(18) 0.0430(12) Uani 1 1 d . . .
H29A H 0.9760 0.9265 0.4252 0.052 Uiso 1 1 calc R . .
C30 C 0.8201(4) 0.8570(3) 0.42975(16) 0.0342(9) Uani 1 1 d . . .
H30A H 0.8648 0.8293 0.4499 0.041 Uiso 1 1 calc R . .
C31 C 0.4526(3) 0.7924(2) 0.44899(12) 0.0196(7) Uani 1 1 d . . .
C32 C 0.3411(4) 0.7925(2) 0.41629(13) 0.0269(8) Uani 1 1 d . . .
H32A H 0.3435 0.7753 0.3844 0.032 Uiso 1 1 calc R . .
C33 C 0.2278(4) 0.8180(2) 0.43105(14) 0.0295(9) Uani 1 1 d . . .
H33A H 0.1544 0.8186 0.4090 0.035 Uiso 1 1 calc R . .
C34 C 0.2222(4) 0.8428(2) 0.47842(15) 0.0316(9) Uani 1 1 d . . .
H34A H 0.1453 0.8601 0.4882 0.038 Uiso 1 1 calc R . .
C35 C 0.3302(4) 0.8418(3) 0.51080(14) 0.0374(10) Uani 1 1 d . . .
H35A H 0.3264 0.8583 0.5427 0.045 Uiso 1 1 calc R . .
C36 C 0.4449(4) 0.8164(2) 0.49648(13) 0.0290(9) Uani 1 1 d . . .
H36A H 0.5174 0.8153 0.5188 0.035 Uiso 1 1 calc R . .
C37 C 0.7955(3) 0.6519(2) 0.34893(12) 0.0211(7) Uani 1 1 d . . .
C38 C 0.9241(4) 0.6387(2) 0.36478(12) 0.0236(8) Uani 1 1 d . . .
H38A H 0.9416 0.6083 0.3870 0.028 Uiso 1 1 calc R . .
C39 C 1.0263(4) 0.6714(2) 0.34710(14) 0.0308(9) Uani 1 1 d . . .
H39A H 1.1122 0.6629 0.3576 0.037 Uiso 1 1 calc R . .
C40 C 1.0002(4) 0.7159(2) 0.31419(15) 0.0325(9) Uani 1 1 d . . .
H40A H 1.0686 0.7374 0.3025 0.039 Uiso 1 1 calc R . .
C41 C 0.8728(4) 0.7290(2) 0.29813(15) 0.0347(10) Uani 1 1 d . . .
H41A H 0.8562 0.7591 0.2758 0.042 Uiso 1 1 calc R . .
C42 C 0.7699(4) 0.6972(2) 0.31540(14) 0.0282(8) Uani 1 1 d . . .
H42A H 0.6844 0.7061 0.3047 0.034 Uiso 1 1 calc R . .
C43 C 0.5639(3) 0.5416(2) 0.32407(12) 0.0189(7) Uani 1 1 d . . .
C44 C 0.6250(4) 0.4951(2) 0.28992(13) 0.0257(8) Uani 1 1 d . . .
H44A H 0.7136 0.5052 0.2897 0.031 Uiso 1 1 calc R . .
C45 C 0.5529(4) 0.4337(2) 0.25627(14) 0.0316(9) Uani 1 1 d . . .
H45A H 0.5931 0.4037 0.2331 0.038 Uiso 1 1 calc R . .
C46 C 0.4219(4) 0.4169(2) 0.25711(14) 0.0310(9) Uani 1 1 d . . .
H46A H 0.3745 0.3748 0.2351 0.037 Uiso 1 1 calc R . .
C47 C 0.3614(4) 0.4632(2) 0.29108(14) 0.0282(8) Uani 1 1 d . . .
H47A H 0.2732 0.4523 0.2916 0.034 Uiso 1 1 calc R . .
C48 C 0.4316(4) 0.5253(2) 0.32406(13) 0.0237(8) Uani 1 1 d . . .
H48A H 0.3901 0.5565 0.3464 0.028 Uiso 1 1 calc R . .
Ag2 Ag 0.24129(3) 0.713543(17) -0.000649(9) 0.02288(7) Uani 1 1 d . . .
Se21 Se 0.49455(4) 0.77064(2) 0.040160(13) 0.02680(9) Uani 1 1 d . . .
Se22 Se 0.22245(4) 0.57635(2) -0.066657(12) 0.02523(9) Uani 1 1 d . . .
P21 P 0.41628(9) 0.78954(5) 0.10407(3) 0.01930(18) Uani 1 1 d . . .
P22 P 0.21133(9) 0.66366(6) 0.06909(3) 0.02030(19) Uani 1 1 d . . .
P23 P 0.11779(9) 0.78094(5) -0.05430(3) 0.01784(18) Uani 1 1 d . . .
P24 P 0.15983(9) 0.63654(5) -0.12027(3) 0.01868(18) Uani 1 1 d . . .
N21 N 0.3352(3) 0.71061(19) 0.11209(11) 0.0234(7) Uani 1 1 d . . .
N22 N 0.0651(3) 0.70961(19) -0.10393(11) 0.0192(6) Uani 1 1 d . . .
Br2 Br 1.13419(4) 0.23769(3) 0.192824(13) 0.03272(10) Uani 1 1 d . . .
C49 C 0.3057(4) 0.8675(2) 0.10795(13) 0.0243(8) Uani 1 1 d . . .
C50 C 0.2100(4) 0.8689(3) 0.13622(15) 0.0340(9) Uani 1 1 d . . .
H50A H 0.1965 0.8271 0.1505 0.041 Uiso 1 1 calc R . .
C51 C 0.1344(5) 0.9332(3) 0.1431(2) 0.0484(12) Uani 1 1 d . . .
H51A H 0.0690 0.9338 0.1616 0.058 Uiso 1 1 calc R . .
C52 C 0.1557(5) 0.9957(3) 0.1229(2) 0.0529(14) Uani 1 1 d . . .
H52A H 0.1068 1.0393 0.1285 0.063 Uiso 1 1 calc R . .
C53 C 0.2489(5) 0.9941(3) 0.09428(19) 0.0471(12) Uani 1 1 d . . .
H53A H 0.2621 1.0362 0.0801 0.056 Uiso 1 1 calc R . .
C54 C 0.3236(4) 0.9297(2) 0.08645(15) 0.0310(9) Uani 1 1 d . . .
H54A H 0.3859 0.9283 0.0667 0.037 Uiso 1 1 calc R . .
C55 C 0.5396(4) 0.8212(2) 0.15571(13) 0.0230(8) Uani 1 1 d . . .
C56 C 0.5078(4) 0.8226(2) 0.20009(13) 0.0312(9) Uani 1 1 d . . .
H56A H 0.4246 0.8039 0.2029 0.037 Uiso 1 1 calc R . .
C57 C 0.5989(5) 0.8516(3) 0.24004(15) 0.0396(11) Uani 1 1 d . . .
H57A H 0.5778 0.8511 0.2695 0.048 Uiso 1 1 calc R . .
C58 C 0.7206(4) 0.8812(3) 0.23600(16) 0.0382(10) Uani 1 1 d . . .
H58A H 0.7813 0.9017 0.2629 0.046 Uiso 1 1 calc R . .
C59 C 0.7534(4) 0.8808(3) 0.19240(16) 0.0406(11) Uani 1 1 d . . .
H59A H 0.8362 0.9005 0.1899 0.049 Uiso 1 1 calc R . .
C60 C 0.6625(4) 0.8506(3) 0.15195(15) 0.0343(9) Uani 1 1 d . . .
H60A H 0.6847 0.8504 0.1225 0.041 Uiso 1 1 calc R . .
C61 C 0.2424(4) 0.5597(2) 0.06021(12) 0.0224(7) Uani 1 1 d . . .
C62 C 0.3643(4) 0.5382(2) 0.04967(14) 0.0299(9) Uani 1 1 d . . .
H62A H 0.4297 0.5772 0.0504 0.036 Uiso 1 1 calc R . .
C63 C 0.3884(4) 0.4595(3) 0.03816(16) 0.0379(10) Uani 1 1 d . . .
H63A H 0.4697 0.4455 0.0312 0.046 Uiso 1 1 calc R . .
C64 C 0.2910(5) 0.4012(3) 0.03702(16) 0.0409(11) Uani 1 1 d . . .
H64A H 0.3073 0.3480 0.0295 0.049 Uiso 1 1 calc R . .
C65 C 0.1702(5) 0.4220(3) 0.04705(17) 0.0416(11) Uani 1 1 d . . .
H65A H 0.1050 0.3827 0.0460 0.050 Uiso 1 1 calc R . .
C66 C 0.1452(4) 0.5010(2) 0.05869(14) 0.0302(9) Uani 1 1 d . . .
H66A H 0.0635 0.5146 0.0655 0.036 Uiso 1 1 calc R . .
C67 C 0.0655(4) 0.6717(2) 0.09601(13) 0.0257(8) Uani 1 1 d . . .
C68 C 0.0617(4) 0.6571(3) 0.14014(16) 0.0376(10) Uani 1 1 d . . .
H68A H 0.1356 0.6421 0.1568 0.045 Uiso 1 1 calc R . .
C69 C -0.0523(5) 0.6648(3) 0.1594(2) 0.0507(13) Uani 1 1 d . . .
H69A H -0.0551 0.6548 0.1890 0.061 Uiso 1 1 calc R . .
C70 C -0.1601(6) 0.6871(4) 0.1349(2) 0.0647(16) Uani 1 1 d . . .
H70A H -0.2365 0.6924 0.1478 0.078 Uiso 1 1 calc R . .
C71 C -0.1569(6) 0.7017(4) 0.0911(2) 0.078(2) Uani 1 1 d . . .
H71A H -0.2313 0.7165 0.0746 0.093 Uiso 1 1 calc R . .
C72 C -0.0438(5) 0.6946(3) 0.07153(18) 0.0520(13) Uani 1 1 d . . .
H72A H -0.0415 0.7052 0.0421 0.062 Uiso 1 1 calc R . .
C73 C 0.2023(3) 0.8593(2) -0.07361(12) 0.0207(7) Uani 1 1 d . . .
C74 C 0.1452(4) 0.8913(2) -0.11029(13) 0.0255(8) Uani 1 1 d . . .
H74A H 0.0589 0.8758 -0.1240 0.031 Uiso 1 1 calc R . .
C75 C 0.2169(4) 0.9462(2) -0.12646(14) 0.0303(9) Uani 1 1 d . . .
H75A H 0.1782 0.9678 -0.1508 0.036 Uiso 1 1 calc R . .
C76 C 0.3454(4) 0.9690(3) -0.10661(15) 0.0355(10) Uani 1 1 d . . .
H76A H 0.3933 1.0056 -0.1177 0.043 Uiso 1 1 calc R . .
C77 C 0.4026(4) 0.9376(3) -0.07033(17) 0.0418(11) Uani 1 1 d . . .
H77A H 0.4892 0.9531 -0.0569 0.050 Uiso 1 1 calc R . .
C78 C 0.3316(4) 0.8827(2) -0.05367(14) 0.0315(9) Uani 1 1 d . . .
H78A H 0.3707 0.8617 -0.0292 0.038 Uiso 1 1 calc R . .
C79 C -0.0313(3) 0.8215(2) -0.03804(12) 0.0206(7) Uani 1 1 d . . .
C80 C -0.1558(4) 0.7918(2) -0.05937(14) 0.0294(9) Uani 1 1 d . . .
H80A H -0.1682 0.7509 -0.0862 0.035 Uiso 1 1 calc R . .
C81 C -0.2631(4) 0.8227(2) -0.04091(16) 0.0352(10) Uani 1 1 d . . .
H81A H -0.3469 0.8020 -0.0554 0.042 Uiso 1 1 calc R . .
C82 C -0.2470(4) 0.8833(2) -0.00174(15) 0.0346(10) Uani 1 1 d . . .
H82A H -0.3193 0.9032 0.0105 0.041 Uiso 1 1 calc R . .
C83 C -0.1246(5) 0.9141(3) 0.01917(18) 0.0578(16) Uani 1 1 d . . .
H83A H -0.1133 0.9558 0.0455 0.069 Uiso 1 1 calc R . .
C84 C -0.0162(5) 0.8835(3) 0.00130(18) 0.0563(15) Uani 1 1 d . . .
H84A H 0.0671 0.9048 0.0159 0.068 Uiso 1 1 calc R . .
C85 C 0.2949(4) 0.6786(2) -0.14215(12) 0.0236(8) Uani 1 1 d . . .
C86 C 0.4236(4) 0.6650(3) -0.12736(14) 0.0314(9) Uani 1 1 d . . .
H86A H 0.4418 0.6321 -0.1066 0.038 Uiso 1 1 calc R . .
C87 C 0.5244(4) 0.7004(3) -0.14363(16) 0.0411(11) Uani 1 1 d . . .
H87A H 0.6103 0.6906 -0.1342 0.049 Uiso 1 1 calc R . .
C88 C 0.4979(5) 0.7502(3) -0.17384(18) 0.0447(12) Uani 1 1 d . . .
H88A H 0.5660 0.7749 -0.1841 0.054 Uiso 1 1 calc R . .
C89 C 0.3705(5) 0.7633(3) -0.18887(17) 0.0393(10) Uani 1 1 d . . .
H89A H 0.3530 0.7961 -0.2098 0.047 Uiso 1 1 calc R . .
C90 C 0.2685(4) 0.7282(2) -0.17316(14) 0.0292(9) Uani 1 1 d . . .
H90A H 0.1828 0.7377 -0.1832 0.035 Uiso 1 1 calc R . .
C91 C 0.0590(3) 0.5708(2) -0.16906(12) 0.0190(7) Uani 1 1 d . . .
C92 C -0.0716(4) 0.5536(2) -0.16723(13) 0.0263(8) Uani 1 1 d . . .
H92A H -0.1091 0.5805 -0.1423 0.032 Uiso 1 1 calc R . .
C93 C -0.1459(4) 0.4968(2) -0.20238(14) 0.0310(9) Uani 1 1 d . . .
H93A H -0.2337 0.4859 -0.2013 0.037 Uiso 1 1 calc R . .
C94 C -0.0901(4) 0.4556(2) -0.23963(14) 0.0307(9) Uani 1 1 d . . .
H94A H -0.1401 0.4165 -0.2630 0.037 Uiso 1 1 calc R . .
C95 C 0.0396(4) 0.4730(2) -0.24163(13) 0.0280(8) Uani 1 1 d . . .
H95A H 0.0767 0.4461 -0.2667 0.034 Uiso 1 1 calc R . .
C96 C 0.1150(4) 0.5303(2) -0.20652(13) 0.0242(8) Uani 1 1 d . . .
H96A H 0.2025 0.5418 -0.2079 0.029 Uiso 1 1 calc R . .
O1 O 0.8817(3) 0.67734(19) 0.69700(10) 0.0355(7) Uani 1 1 d . . .
C01 C 1.0113(5) 0.6515(3) 0.70557(17) 0.0506(13) Uani 1 1 d . . .
H01A H 1.0241 0.6347 0.7350 0.061 Uiso 1 1 calc R . .
H01B H 1.0759 0.6950 0.7077 0.061 Uiso 1 1 calc R . .
C02 C 1.0270(6) 0.5853(3) 0.66684(18) 0.0568(14) Uani 1 1 d . . .
H02A H 1.1131 0.5679 0.6723 0.085 Uiso 1 1 calc R . .
H02B H 1.0149 0.6025 0.6378 0.085 Uiso 1 1 calc R . .
H02C H 0.9634 0.5424 0.6651 0.085 Uiso 1 1 calc R . .
O2 O 0.3954(3) 0.6335(2) 0.18455(11) 0.0417(8) Uani 1 1 d . . .
C03 C 0.5051(13) 0.5923(9) 0.1900(4) 0.235(10) Uani 1 1 d . . .
H03A H 0.5634 0.6265 0.2160 0.282 Uiso 1 1 calc R . .
H03B H 0.4764 0.5476 0.2020 0.282 Uiso 1 1 calc R . .
C04 C 0.5751(9) 0.5653(6) 0.1629(3) 0.120(4) Uani 1 1 d . . .
H04A H 0.6565 0.5558 0.1799 0.180 Uiso 1 1 calc R . .
H04B H 0.5907 0.6022 0.1440 0.180 Uiso 1 1 calc R . .
H04C H 0.5342 0.5164 0.1431 0.180 Uiso 1 1 calc R . .
O3 O 0.5419(8) 0.9595(5) 0.7098(3) 0.140(3) Uiso 1 1 d . . .
C06 C 0.5576(10) 0.9522(6) 0.7833(4) 0.125(3) Uiso 1 1 d . . .
H06A H 0.5823 0.9367 0.8124 0.188 Uiso 1 1 calc R . .
H06B H 0.4650 0.9419 0.7736 0.188 Uiso 1 1 calc R . .
H06C H 0.5816 1.0077 0.7874 0.188 Uiso 1 1 calc R . .
C05 C 0.6246(11) 0.9069(6) 0.7475(4) 0.129(3) Uiso 1 1 d . . .
H05A H 0.5998 0.8504 0.7395 0.155 Uiso 1 1 calc R . .
H05B H 0.7187 0.9180 0.7533 0.155 Uiso 1 1 calc R . .
H11 H 0.832(4) 0.710(3) 0.6318(17) 0.033(13) Uiso 1 1 d . . .
H12 H 0.519(5) 0.692(3) 0.3597(18) 0.044(14) Uiso 1 1 d . . .
H21 H 0.364(5) 0.691(3) 0.1308(19) 0.044(15) Uiso 1 1 d . . .
H22 H 0.023(5) 0.720(3) -0.1212(17) 0.034(14) Uiso 1 1 d . . .
H1 H 0.860(6) 0.696(4) 0.722(2) 0.080 Uiso 1 1 d . . .
H2 H 0.387(7) 0.654(4) 0.208(2) 0.080 Uiso 1 1 d . . .
H3 H 0.497(6) 0.998(4) 0.721(2) 0.080 Uiso 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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Se Se -0.0929 2.2259 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Br Br -0.2901 2.4595 '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'
O O 0.0106 0.0060 '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
P13 Ag1 P12 136.37(3) . . ?
P13 Ag1 Se12 91.99(2) . . ?
P12 Ag1 Se12 105.48(2) . . ?
P13 Ag1 Se11 122.06(3) . . ?
P12 Ag1 Se11 88.12(2) . . ?
Se12 Ag1 Se11 112.287(15) . . ?
P11 Se11 Ag1 82.92(3) . . ?
P14 Se12 Ag1 92.08(3) . . ?
N11 P11 C1 104.20(17) . . ?
N11 P11 C7 106.96(18) . . ?
C1 P11 C7 106.81(18) . . ?
N11 P11 Se11 113.49(12) . . ?
C1 P11 Se11 114.18(14) . . ?
C7 P11 Se11 110.64(14) . . ?
N11 P12 C19 104.75(16) . . ?
N11 P12 C13 105.38(16) . . ?
C19 P12 C13 105.23(16) . . ?
N11 P12 Ag1 105.57(12) . . ?
C19 P12 Ag1 125.87(12) . . ?
C13 P12 Ag1 108.42(11) . . ?
N12 P13 C31 103.45(15) . . ?
N12 P13 C25 105.03(15) . . ?
C31 P13 C25 106.19(16) . . ?
N12 P13 Ag1 105.77(11) . . ?
C31 P13 Ag1 115.19(12) . . ?
C25 P13 Ag1 119.56(12) . . ?
N12 P14 C43 104.44(16) . . ?
N12 P14 C37 107.48(16) . . ?
C43 P14 C37 107.40(16) . . ?
N12 P14 Se12 113.59(11) . . ?
C43 P14 Se12 110.48(12) . . ?
C37 P14 Se12 112.94(12) . . ?
P11 N11 P12 118.4(2) . . ?
P11 N11 H11 118(4) . . ?
P12 N11 H11 124(4) . . ?
P14 N12 P13 120.32(18) . . ?
P14 N12 H12 109(3) . . ?
P13 N12 H12 124(3) . . ?
C6 C1 C2 120.0(4) . . ?
C6 C1 P11 120.8(3) . . ?
C2 C1 P11 119.2(3) . . ?
C3 C2 C1 119.7(4) . . ?
C3 C2 H2A 120.1 . . ?
C1 C2 H2A 120.1 . . ?
C4 C3 C2 119.8(5) . . ?
C4 C3 H3A 120.1 . . ?
C2 C3 H3A 120.1 . . ?
C5 C4 C3 120.9(4) . . ?
C5 C4 H4A 119.5 . . ?
C3 C4 H4A 119.5 . . ?
C4 C5 C6 119.8(4) . . ?
C4 C5 H5A 120.1 . . ?
C6 C5 H5A 120.1 . . ?
C1 C6 C5 119.7(4) . . ?
C1 C6 H6A 120.2 . . ?
C5 C6 H6A 120.2 . . ?
C8 C7 C12 120.1(4) . . ?
C8 C7 P11 120.5(3) . . ?
C12 C7 P11 119.4(3) . . ?
C7 C8 C9 119.5(5) . . ?
C7 C8 H8A 120.3 . . ?
C9 C8 H8A 120.3 . . ?
C10 C9 C8 120.2(5) . . ?
C10 C9 H9A 119.9 . . ?
C8 C9 H9A 119.9 . . ?
C11 C10 C9 120.4(5) . . ?
C11 C10 H10A 119.8 . . ?
C9 C10 H10A 119.8 . . ?
C10 C11 C12 120.1(5) . . ?
C10 C11 H11A 119.9 . . ?
C12 C11 H11A 119.9 . . ?
C11 C12 C7 119.6(5) . . ?
C11 C12 H12A 120.2 . . ?
C7 C12 H12A 120.2 . . ?
C18 C13 C14 118.9(3) . . ?
C18 C13 P12 122.3(3) . . ?
C14 C13 P12 118.5(3) . . ?
C15 C14 C13 120.9(4) . . ?
C15 C14 H14A 119.6 . . ?
C13 C14 H14A 119.6 . . ?
C14 C15 C16 120.0(4) . . ?
C14 C15 H15A 120.0 . . ?
C16 C15 H15A 120.0 . . ?
C17 C16 C15 119.6(4) . . ?
C17 C16 H16A 120.2 . . ?
C15 C16 H16A 120.2 . . ?
C16 C17 C18 120.5(4) . . ?
C16 C17 H17A 119.7 . . ?
C18 C17 H17A 119.7 . . ?
C17 C18 C13 120.0(4) . . ?
C17 C18 H18A 120.0 . . ?
C13 C18 H18A 120.0 . . ?
C20 C19 C24 119.4(4) . . ?
C20 C19 P12 117.7(3) . . ?
C24 C19 P12 123.0(3) . . ?
C19 C20 C21 120.3(4) . . ?
C19 C20 H20A 119.8 . . ?
C21 C20 H20A 119.8 . . ?
C22 C21 C20 119.8(4) . . ?
C22 C21 H21A 120.1 . . ?
C20 C21 H21A 120.1 . . ?
C23 C22 C21 120.4(4) . . ?
C23 C22 H22A 119.8 . . ?
C21 C22 H22A 119.8 . . ?
C22 C23 C24 120.1(4) . . ?
C22 C23 H23A 120.0 . . ?
C24 C23 H23A 120.0 . . ?
C23 C24 C19 120.0(4) . . ?
C23 C24 H24A 120.0 . . ?
C19 C24 H24A 120.0 . . ?
C30 C25 C26 118.9(3) . . ?
C30 C25 P13 117.6(3) . . ?
C26 C25 P13 123.5(3) . . ?
C27 C26 C25 120.1(4) . . ?
C27 C26 H26A 119.9 . . ?
C25 C26 H26A 119.9 . . ?
C28 C27 C26 120.3(4) . . ?
C28 C27 H27A 119.9 . . ?
C26 C27 H27A 119.9 . . ?
C27 C28 C29 119.7(4) . . ?
C27 C28 H28A 120.2 . . ?
C29 C28 H28A 120.2 . . ?
C30 C29 C28 120.4(4) . . ?
C30 C29 H29A 119.8 . . ?
C28 C29 H29A 119.8 . . ?
C29 C30 C25 120.6(4) . . ?
C29 C30 H30A 119.7 . . ?
C25 C30 H30A 119.7 . . ?
C36 C31 C32 118.5(3) . . ?
C36 C31 P13 116.4(3) . . ?
C32 C31 P13 125.0(3) . . ?
C33 C32 C31 120.3(4) . . ?
C33 C32 H32A 119.8 . . ?
C31 C32 H32A 119.8 . . ?
C32 C33 C34 120.5(4) . . ?
C32 C33 H33A 119.8 . . ?
C34 C33 H33A 119.8 . . ?
C35 C34 C33 119.7(4) . . ?
C35 C34 H34A 120.1 . . ?
C33 C34 H34A 120.1 . . ?
C34 C35 C36 120.4(4) . . ?
C34 C35 H35A 119.8 . . ?
C36 C35 H35A 119.8 . . ?
C35 C36 C31 120.5(4) . . ?
C35 C36 H36A 119.8 . . ?
C31 C36 H36A 119.8 . . ?
C42 C37 C38 119.9(3) . . ?
C42 C37 P14 119.1(3) . . ?
C38 C37 P14 121.0(3) . . ?
C39 C38 C37 119.7(4) . . ?
C39 C38 H38A 120.2 . . ?
C37 C38 H38A 120.2 . . ?
C40 C39 C38 120.1(4) . . ?
C40 C39 H39A 120.0 . . ?
C38 C39 H39A 120.0 . . ?
C39 C40 C41 120.6(4) . . ?
C39 C40 H40A 119.7 . . ?
C41 C40 H40A 119.7 . . ?
C40 C41 C42 120.1(4) . . ?
C40 C41 H41A 119.9 . . ?
C42 C41 H41A 119.9 . . ?
C41 C42 C37 119.6(4) . . ?
C41 C42 H42A 120.2 . . ?
C37 C42 H42A 120.2 . . ?
C48 C43 C44 119.4(3) . . ?
C48 C43 P14 120.6(3) . . ?
C44 C43 P14 119.5(3) . . ?
C45 C44 C43 119.8(4) . . ?
C45 C44 H44A 120.1 . . ?
C43 C44 H44A 120.1 . . ?
C46 C45 C44 120.4(4) . . ?
C46 C45 H45A 119.8 . . ?
C44 C45 H45A 119.8 . . ?
C45 C46 C47 119.6(4) . . ?
C45 C46 H46A 120.2 . . ?
C47 C46 H46A 120.2 . . ?
C48 C47 C46 120.4(4) . . ?
C48 C47 H47A 119.8 . . ?
C46 C47 H47A 119.8 . . ?
C47 C48 C43 120.4(4) . . ?
C47 C48 H48A 119.8 . . ?
C43 C48 H48A 119.8 . . ?
P23 Ag2 P22 137.95(3) . . ?
P23 Ag2 Se22 92.67(2) . . ?
P22 Ag2 Se22 101.07(3) . . ?
P23 Ag2 Se21 119.93(3) . . ?
P22 Ag2 Se21 90.15(2) . . ?
Se22 Ag2 Se21 114.362(15) . . ?
P21 Se21 Ag2 84.06(3) . . ?
P24 Se22 Ag2 90.64(3) . . ?
N21 P21 C55 105.50(17) . . ?
N21 P21 C49 106.68(17) . . ?
C55 P21 C49 104.72(17) . . ?
N21 P21 Se21 114.24(12) . . ?
C55 P21 Se21 113.16(13) . . ?
C49 P21 Se21 111.80(13) . . ?
N21 P22 C67 105.48(17) . . ?
N21 P22 C61 104.12(16) . . ?
C67 P22 C61 105.16(17) . . ?
N21 P22 Ag2 105.58(12) . . ?
C67 P22 Ag2 124.39(13) . . ?
C61 P22 Ag2 110.35(12) . . ?
N22 P23 C79 103.86(16) . . ?
N22 P23 C73 105.30(16) . . ?
C79 P23 C73 104.91(16) . . ?
N22 P23 Ag2 105.20(12) . . ?
C79 P23 Ag2 117.47(12) . . ?
C73 P23 Ag2 118.52(12) . . ?
N22 P24 C91 103.87(16) . . ?
N22 P24 C85 107.46(17) . . ?
C91 P24 C85 107.80(16) . . ?
N22 P24 Se22 113.77(12) . . ?
C91 P24 Se22 110.76(12) . . ?
C85 P24 Se22 112.65(13) . . ?
P21 N21 P22 118.3(2) . . ?
P21 N21 H21 119(4) . . ?
P22 N21 H21 121(4) . . ?
P24 N22 P23 119.49(19) . . ?
P24 N22 H22 118(4) . . ?
P23 N22 H22 117(4) . . ?
C54 C49 C50 119.5(4) . . ?
C54 C49 P21 120.4(3) . . ?
C50 C49 P21 119.8(3) . . ?
C49 C50 C51 119.7(4) . . ?
C49 C50 H50A 120.1 . . ?
C51 C50 H50A 120.1 . . ?
C52 C51 C50 120.3(5) . . ?
C52 C51 H51A 119.8 . . ?
C50 C51 H51A 119.8 . . ?
C51 C52 C53 120.2(4) . . ?
C51 C52 H52A 119.9 . . ?
C53 C52 H52A 119.9 . . ?
C52 C53 C54 120.0(5) . . ?
C52 C53 H53A 120.0 . . ?
C54 C53 H53A 120.0 . . ?
C49 C54 C53 120.2(4) . . ?
C49 C54 H54A 119.9 . . ?
C53 C54 H54A 119.9 . . ?
C60 C55 C56 119.3(4) . . ?
C60 C55 P21 120.4(3) . . ?
C56 C55 P21 120.0(3) . . ?
C57 C56 C55 120.6(4) . . ?
C57 C56 H56A 119.7 . . ?
C55 C56 H56A 119.7 . . ?
C58 C57 C56 119.7(4) . . ?
C58 C57 H57A 120.1 . . ?
C56 C57 H57A 120.1 . . ?
C57 C58 C59 120.4(4) . . ?
C57 C58 H58A 119.8 . . ?
C59 C58 H58A 119.8 . . ?
C58 C59 C60 120.1(4) . . ?
C58 C59 H59A 119.9 . . ?
C60 C59 H59A 119.9 . . ?
C55 C60 C59 119.8(4) . . ?
C55 C60 H60A 120.1 . . ?
C59 C60 H60A 120.1 . . ?
C66 C61 C62 119.3(4) . . ?
C66 C61 P22 122.1(3) . . ?
C62 C61 P22 118.2(3) . . ?
C63 C62 C61 120.4(4) . . ?
C63 C62 H62A 119.8 . . ?
C61 C62 H62A 119.8 . . ?
C62 C63 C64 119.9(4) . . ?
C62 C63 H63A 120.1 . . ?
C64 C63 H63A 120.1 . . ?
C65 C64 C63 120.0(4) . . ?
C65 C64 H64A 120.0 . . ?
C63 C64 H64A 120.0 . . ?
C64 C65 C66 120.5(4) . . ?
C64 C65 H65A 119.7 . . ?
C66 C65 H65A 119.7 . . ?
C65 C66 C61 119.9(4) . . ?
C65 C66 H66A 120.1 . . ?
C61 C66 H66A 120.1 . . ?
C72 C67 C68 119.9(4) . . ?
C72 C67 P22 117.8(3) . . ?
C68 C67 P22 122.3(3) . . ?
C69 C68 C67 120.1(4) . . ?
C69 C68 H68A 120.0 . . ?
C67 C68 H68A 120.0 . . ?
C70 C69 C68 119.7(5) . . ?
C70 C69 H69A 120.2 . . ?
C68 C69 H69A 120.2 . . ?
C69 C70 C71 120.5(5) . . ?
C69 C70 H70A 119.7 . . ?
C71 C70 H70A 119.7 . . ?
C70 C71 C72 120.5(5) . . ?
C70 C71 H71A 119.8 . . ?
C72 C71 H71A 119.8 . . ?
C67 C72 C71 119.4(5) . . ?
C67 C72 H72A 120.3 . . ?
C71 C72 H72A 120.3 . . ?
C78 C73 C74 119.3(3) . . ?
C78 C73 P23 118.4(3) . . ?
C74 C73 P23 122.0(3) . . ?
C75 C74 C73 120.1(4) . . ?
C75 C74 H74A 120.0 . . ?
C73 C74 H74A 120.0 . . ?
C76 C75 C74 120.3(4) . . ?
C76 C75 H75A 119.9 . . ?
C74 C75 H75A 119.9 . . ?
C77 C76 C75 120.0(4) . . ?
C77 C76 H76A 120.0 . . ?
C75 C76 H76A 120.0 . . ?
C76 C77 C78 120.3(4) . . ?
C76 C77 H77A 119.9 . . ?
C78 C77 H77A 119.9 . . ?
C73 C78 C77 120.0(4) . . ?
C73 C78 H78A 120.0 . . ?
C77 C78 H78A 120.0 . . ?
C80 C79 C84 118.5(3) . . ?
C80 C79 P23 125.2(3) . . ?
C84 C79 P23 116.1(3) . . ?
C79 C80 C81 120.1(4) . . ?
C79 C80 H80A 119.9 . . ?
C81 C80 H80A 119.9 . . ?
C82 C81 C80 120.8(4) . . ?
C82 C81 H81A 119.6 . . ?
C80 C81 H81A 119.6 . . ?
C83 C82 C81 119.6(4) . . ?
C83 C82 H82A 120.2 . . ?
C81 C82 H82A 120.2 . . ?
C82 C83 C84 120.3(4) . . ?
C82 C83 H83A 119.9 . . ?
C84 C83 H83A 119.9 . . ?
C79 C84 C83 120.7(4) . . ?
C79 C84 H84A 119.7 . . ?
C83 C84 H84A 119.7 . . ?
C86 C85 C90 119.7(4) . . ?
C86 C85 P24 121.7(3) . . ?
C90 C85 P24 118.6(3) . . ?
C87 C86 C85 119.9(4) . . ?
C87 C86 H86A 120.0 . . ?
C85 C86 H86A 120.0 . . ?
C88 C87 C86 120.2(4) . . ?
C88 C87 H87A 119.9 . . ?
C86 C87 H87A 119.9 . . ?
C87 C88 C89 120.0(4) . . ?
C87 C88 H88A 120.0 . . ?
C89 C88 H88A 120.0 . . ?
C88 C89 C90 120.6(4) . . ?
C88 C89 H89A 119.7 . . ?
C90 C89 H89A 119.7 . . ?
C89 C90 C85 119.6(4) . . ?
C89 C90 H90A 120.2 . . ?
C85 C90 H90A 120.2 . . ?
C92 C91 C96 119.9(3) . . ?
C92 C91 P24 119.9(3) . . ?
C96 C91 P24 119.8(3) . . ?
C93 C92 C91 120.0(4) . . ?
C93 C92 H92A 120.0 . . ?
C91 C92 H92A 120.0 . . ?
C92 C93 C94 120.4(4) . . ?
C92 C93 H93A 119.8 . . ?
C94 C93 H93A 119.8 . . ?
C95 C94 C93 119.6(3) . . ?
C95 C94 H94A 120.2 . . ?
C93 C94 H94A 120.2 . . ?
C94 C95 C96 120.4(4) . . ?
C94 C95 H95A 119.8 . . ?
C96 C95 H95A 119.8 . . ?
C95 C96 C91 119.7(4) . . ?
C95 C96 H96A 120.2 . . ?
C91 C96 H96A 120.2 . . ?
C01 O1 H1 108(5) . . ?
O1 C01 C02 109.0(4) . . ?
O1 C01 H01A 109.9 . . ?
C02 C01 H01A 109.9 . . ?
O1 C01 H01B 109.9 . . ?
C02 C01 H01B 109.9 . . ?
H01A C01 H01B 108.3 . . ?
C01 C02 H02A 109.5 . . ?
C01 C02 H02B 109.5 . . ?
H02A C02 H02B 109.5 . . ?
C01 C02 H02C 109.5 . . ?
H02A C02 H02C 109.5 . . ?
H02B C02 H02C 109.5 . . ?
C03 O2 H2 106(6) . . ?
C04 C03 O2 131.3(8) . . ?
C04 C03 H03A 104.4 . . ?
O2 C03 H03A 104.4 . . ?
C04 C03 H03B 104.4 . . ?
O2 C03 H03B 104.4 . . ?
H03A C03 H03B 105.6 . . ?
C03 C04 H04A 109.5 . . ?
C03 C04 H04B 109.5 . . ?
H04A C04 H04B 109.5 . . ?
C03 C04 H04C 109.5 . . ?
H04A C04 H04C 109.5 . . ?
H04B C04 H04C 109.5 . . ?
C05 O3 H3 119(5) . . ?
C05 C06 H06A 109.5 . . ?
C05 C06 H06B 109.5 . . ?
H06A C06 H06B 109.5 . . ?
C05 C06 H06C 109.5 . . ?
H06A C06 H06C 109.5 . . ?
H06B C06 H06C 109.5 . . ?
C06 C05 O3 85.5(7) . . ?
C06 C05 H05A 114.4 . . ?
O3 C05 H05A 114.4 . . ?
C06 C05 H05B 114.4 . . ?
O3 C05 H05B 114.4 . . ?
H05A C05 H05B 111.5 . . ?
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
Ag1 P13 2.4453(9) . ?
Ag1 P12 2.4740(9) . ?
Ag1 Se12 2.7008(4) . ?
Ag1 Se11 2.8050(5) . ?
Se11 P11 2.1280(10) . ?
Se12 P14 2.1254(9) . ?
P11 N11 1.653(3) . ?
P11 C1 1.811(4) . ?
P11 C7 1.817(4) . ?
P12 N11 1.704(3) . ?
P12 C19 1.810(4) . ?
P12 C13 1.818(4) . ?
P13 N12 1.710(3) . ?
P13 C31 1.818(4) . ?
P13 C25 1.829(4) . ?
P14 N12 1.674(3) . ?
P14 C43 1.795(3) . ?
P14 C37 1.807(4) . ?
N11 H11 0.73(5) . ?
N12 H12 0.86(5) . ?
C1 C6 1.379(6) . ?
C1 C2 1.398(6) . ?
C2 C3 1.384(6) . ?
C2 H2A 0.9300 . ?
C3 C4 1.378(7) . ?
C3 H3A 0.9300 . ?
C4 C5 1.371(7) . ?
C4 H4A 0.9300 . ?
C5 C6 1.399(6) . ?
C5 H5A 0.9300 . ?
C6 H6A 0.9300 . ?
C7 C8 1.380(6) . ?
C7 C12 1.399(6) . ?
C8 C9 1.391(6) . ?
C8 H8A 0.9300 . ?
C9 C10 1.389(8) . ?
C9 H9A 0.9300 . ?
C10 C11 1.367(8) . ?
C10 H10A 0.9300 . ?
C11 C12 1.392(6) . ?
C11 H11A 0.9300 . ?
C12 H12A 0.9300 . ?
C13 C18 1.391(5) . ?
C13 C14 1.398(5) . ?
C14 C15 1.377(5) . ?
C14 H14A 0.9300 . ?
C15 C16 1.391(6) . ?
C15 H15A 0.9300 . ?
C16 C17 1.383(6) . ?
C16 H16A 0.9300 . ?
C17 C18 1.391(5) . ?
C17 H17A 0.9300 . ?
C18 H18A 0.9300 . ?
C19 C20 1.384(5) . ?
C19 C24 1.391(5) . ?
C20 C21 1.384(6) . ?
C20 H20A 0.9300 . ?
C21 C22 1.378(7) . ?
C21 H21A 0.9300 . ?
C22 C23 1.375(7) . ?
C22 H22A 0.9300 . ?
C23 C24 1.383(6) . ?
C23 H23A 0.9300 . ?
C24 H24A 0.9300 . ?
C25 C30 1.385(5) . ?
C25 C26 1.398(5) . ?
C26 C27 1.387(5) . ?
C26 H26A 0.9300 . ?
C27 C28 1.378(6) . ?
C27 H27A 0.9300 . ?
C28 C29 1.382(6) . ?
C28 H28A 0.9300 . ?
C29 C30 1.379(6) . ?
C29 H29A 0.9300 . ?
C30 H30A 0.9300 . ?
C31 C36 1.390(5) . ?
C31 C32 1.397(5) . ?
C32 C33 1.373(5) . ?
C32 H32A 0.9300 . ?
C33 C34 1.383(6) . ?
C33 H33A 0.9300 . ?
C34 C35 1.368(6) . ?
C34 H34A 0.9300 . ?
C35 C36 1.382(6) . ?
C35 H35A 0.9300 . ?
C36 H36A 0.9300 . ?
C37 C42 1.397(5) . ?
C37 C38 1.396(5) . ?
C38 C39 1.398(5) . ?
C38 H38A 0.9300 . ?
C39 C40 1.372(6) . ?
C39 H39A 0.9300 . ?
C40 C41 1.386(6) . ?
C40 H40A 0.9300 . ?
C41 C42 1.390(5) . ?
C41 H41A 0.9300 . ?
C42 H42A 0.9300 . ?
C43 C48 1.390(5) . ?
C43 C44 1.398(5) . ?
C44 C45 1.390(5) . ?
C44 H44A 0.9300 . ?
C45 C46 1.384(6) . ?
C45 H45A 0.9300 . ?
C46 C47 1.389(6) . ?
C46 H46A 0.9300 . ?
C47 C48 1.381(5) . ?
C47 H47A 0.9300 . ?
C48 H48A 0.9300 . ?
Ag2 P23 2.4247(9) . ?
Ag2 P22 2.4543(9) . ?
Ag2 Se22 2.7094(5) . ?
Ag2 Se21 2.7695(5) . ?
Se21 P21 2.1306(10) . ?
Se22 P24 2.1221(10) . ?
P21 N21 1.652(3) . ?
P21 C55 1.809(4) . ?
P21 C49 1.812(4) . ?
P22 N21 1.706(3) . ?
P22 C67 1.808(4) . ?
P22 C61 1.816(4) . ?
P23 N22 1.702(3) . ?
P23 C79 1.817(4) . ?
P23 C73 1.820(4) . ?
P24 N22 1.674(3) . ?
P24 C91 1.792(3) . ?
P24 C85 1.814(4) . ?
N21 H21 0.75(5) . ?
N22 H22 0.69(5) . ?
C49 C54 1.383(5) . ?
C49 C50 1.386(6) . ?
C50 C51 1.391(6) . ?
C50 H50A 0.9300 . ?
C51 C52 1.370(7) . ?
C51 H51A 0.9300 . ?
C52 C53 1.372(8) . ?
C52 H52A 0.9300 . ?
C53 C54 1.388(6) . ?
C53 H53A 0.9300 . ?
C54 H54A 0.9300 . ?
C55 C60 1.381(6) . ?
C55 C56 1.394(5) . ?
C56 C57 1.384(5) . ?
C56 H56A 0.9300 . ?
C57 C58 1.373(6) . ?
C57 H57A 0.9300 . ?
C58 C59 1.378(7) . ?
C58 H58A 0.9300 . ?
C59 C60 1.395(6) . ?
C59 H59A 0.9300 . ?
C60 H60A 0.9300 . ?
C61 C66 1.389(5) . ?
C61 C62 1.396(5) . ?
C62 C63 1.378(6) . ?
C62 H62A 0.9300 . ?
C63 C64 1.387(6) . ?
C63 H63A 0.9300 . ?
C64 C65 1.378(6) . ?
C64 H64A 0.9300 . ?
C65 C66 1.385(6) . ?
C65 H65A 0.9300 . ?
C66 H66A 0.9300 . ?
C67 C72 1.378(6) . ?
C67 C68 1.387(6) . ?
C68 C69 1.387(6) . ?
C68 H68A 0.9300 . ?
C69 C70 1.362(8) . ?
C69 H69A 0.9300 . ?
C70 C71 1.375(9) . ?
C70 H70A 0.9300 . ?
C71 C72 1.383(7) . ?
C71 H71A 0.9300 . ?
C72 H72A 0.9300 . ?
C73 C78 1.389(5) . ?
C73 C74 1.392(5) . ?
C74 C75 1.387(6) . ?
C74 H74A 0.9300 . ?
C75 C76 1.380(6) . ?
C75 H75A 0.9300 . ?
C76 C77 1.378(6) . ?
C76 H76A 0.9300 . ?
C77 C78 1.390(6) . ?
C77 H77A 0.9300 . ?
C78 H78A 0.9300 . ?
C79 C80 1.377(5) . ?
C79 C84 1.386(5) . ?
C80 C81 1.392(5) . ?
C80 H80A 0.9300 . ?
C81 C82 1.368(6) . ?
C81 H81A 0.9300 . ?
C82 C83 1.359(7) . ?
C82 H82A 0.9300 . ?
C83 C84 1.392(6) . ?
C83 H83A 0.9300 . ?
C84 H84A 0.9300 . ?
C85 C86 1.392(5) . ?
C85 C90 1.395(6) . ?
C86 C87 1.386(6) . ?
C86 H86A 0.9300 . ?
C87 C88 1.379(7) . ?
C87 H87A 0.9300 . ?
C88 C89 1.380(7) . ?
C88 H88A 0.9300 . ?
C89 C90 1.383(6) . ?
C89 H89A 0.9300 . ?
C90 H90A 0.9300 . ?
C91 C92 1.386(5) . ?
C91 C96 1.395(5) . ?
C92 C93 1.377(5) . ?
C92 H92A 0.9300 . ?
C93 C94 1.394(6) . ?
C93 H93A 0.9300 . ?
C94 C95 1.380(6) . ?
C94 H94A 0.9300 . ?
C95 C96 1.386(5) . ?
C95 H95A 0.9300 . ?
C96 H96A 0.9300 . ?
O1 C01 1.444(6) . ?
O1 H1 0.82(7) . ?
C01 C02 1.469(7) . ?
C01 H01A 0.9700 . ?
C01 H01B 0.9700 . ?
C02 H02A 0.9600 . ?
C02 H02B 0.9600 . ?
C02 H02C 0.9600 . ?
O2 C03 1.383(8) . ?
O2 H2 0.72(7) . ?
C03 C04 1.195(10) . ?
C03 H03A 0.9700 . ?
C03 H03B 0.9700 . ?
C04 H04A 0.9600 . ?
C04 H04B 0.9600 . ?
C04 H04C 0.9600 . ?
O3 C05 1.746(12) . ?
O3 H3 0.87(7) . ?
C06 C05 1.457(12) . ?
C06 H06A 0.9600 . ?
C06 H06B 0.9600 . ?
C06 H06C 0.9600 . ?
C05 H05A 0.9700 . ?
C05 H05B 0.9700 . ?
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
P13 Ag1 Se11 P11 109.32(4) . . . . ?
P12 Ag1 Se11 P11 -37.20(3) . . . . ?
Se12 Ag1 Se11 P11 -143.17(3) . . . . ?
P13 Ag1 Se12 P14 14.24(3) . . . . ?
P12 Ag1 Se12 P14 153.80(3) . . . . ?
Se11 Ag1 Se12 P14 -111.79(3) . . . . ?
Ag1 Se11 P11 N11 56.00(13) . . . . ?
Ag1 Se11 P11 C1 175.23(14) . . . . ?
Ag1 Se11 P11 C7 -64.24(13) . . . . ?
P13 Ag1 P12 N11 -115.61(12) . . . . ?
Se12 Ag1 P12 N11 134.35(12) . . . . ?
Se11 Ag1 P12 N11 21.73(12) . . . . ?
P13 Ag1 P12 C19 6.23(16) . . . . ?
Se12 Ag1 P12 C19 -103.81(15) . . . . ?
Se11 Ag1 P12 C19 143.57(15) . . . . ?
P13 Ag1 P12 C13 131.87(12) . . . . ?
Se12 Ag1 P12 C13 21.83(12) . . . . ?
Se11 Ag1 P12 C13 -90.79(12) . . . . ?
P12 Ag1 P13 N12 -110.10(11) . . . . ?
Se12 Ag1 P13 N12 4.95(11) . . . . ?
Se11 Ag1 P13 N12 122.95(11) . . . . ?
P12 Ag1 P13 C31 3.47(14) . . . . ?
Se12 Ag1 P13 C31 118.52(13) . . . . ?
Se11 Ag1 P13 C31 -123.47(12) . . . . ?
P12 Ag1 P13 C25 131.86(13) . . . . ?
Se12 Ag1 P13 C25 -113.09(13) . . . . ?
Se11 Ag1 P13 C25 4.92(14) . . . . ?
Ag1 Se12 P14 N12 -34.43(12) . . . . ?
Ag1 Se12 P14 C43 -151.39(13) . . . . ?
Ag1 Se12 P14 C37 88.31(12) . . . . ?
C1 P11 N11 P12 -178.2(2) . . . . ?
C7 P11 N11 P12 68.9(2) . . . . ?
Se11 P11 N11 P12 -53.4(2) . . . . ?
C19 P12 N11 P11 -124.1(2) . . . . ?
C13 P12 N11 P11 125.2(2) . . . . ?
Ag1 P12 N11 P11 10.5(2) . . . . ?
C43 P14 N12 P13 170.17(19) . . . . ?
C37 P14 N12 P13 -76.0(2) . . . . ?
Se12 P14 N12 P13 49.7(2) . . . . ?
C31 P13 N12 P14 -153.5(2) . . . . ?
C25 P13 N12 P14 95.3(2) . . . . ?
Ag1 P13 N12 P14 -32.0(2) . . . . ?
N11 P11 C1 C6 130.5(3) . . . . ?
C7 P11 C1 C6 -116.5(3) . . . . ?
Se11 P11 C1 C6 6.2(4) . . . . ?
N11 P11 C1 C2 -50.2(4) . . . . ?
C7 P11 C1 C2 62.8(4) . . . . ?
Se11 P11 C1 C2 -174.6(3) . . . . ?
C6 C1 C2 C3 -0.3(7) . . . . ?
P11 C1 C2 C3 -179.6(4) . . . . ?
C1 C2 C3 C4 1.1(7) . . . . ?
C2 C3 C4 C5 -0.8(8) . . . . ?
C3 C4 C5 C6 -0.2(7) . . . . ?
C2 C1 C6 C5 -0.6(6) . . . . ?
P11 C1 C6 C5 178.6(3) . . . . ?
C4 C5 C6 C1 0.9(7) . . . . ?
N11 P11 C7 C8 31.3(4) . . . . ?
C1 P11 C7 C8 -79.8(4) . . . . ?
Se11 P11 C7 C8 155.4(3) . . . . ?
N11 P11 C7 C12 -149.4(3) . . . . ?
C1 P11 C7 C12 99.5(3) . . . . ?
Se11 P11 C7 C12 -25.4(4) . . . . ?
C12 C7 C8 C9 0.3(6) . . . . ?
P11 C7 C8 C9 179.5(3) . . . . ?
C7 C8 C9 C10 0.0(7) . . . . ?
C8 C9 C10 C11 0.3(8) . . . . ?
C9 C10 C11 C12 -0.9(8) . . . . ?
C10 C11 C12 C7 1.2(7) . . . . ?
C8 C7 C12 C11 -0.8(6) . . . . ?
P11 C7 C12 C11 179.9(4) . . . . ?
N11 P12 C13 C18 123.4(3) . . . . ?
C19 P12 C13 C18 13.0(3) . . . . ?
Ag1 P12 C13 C18 -123.9(3) . . . . ?
N11 P12 C13 C14 -63.3(3) . . . . ?
C19 P12 C13 C14 -173.7(3) . . . . ?
Ag1 P12 C13 C14 49.3(3) . . . . ?
C18 C13 C14 C15 -1.4(5) . . . . ?
P12 C13 C14 C15 -174.9(3) . . . . ?
C13 C14 C15 C16 0.9(6) . . . . ?
C14 C15 C16 C17 -0.1(6) . . . . ?
C15 C16 C17 C18 -0.3(6) . . . . ?
C16 C17 C18 C13 -0.2(6) . . . . ?
C14 C13 C18 C17 1.0(5) . . . . ?
P12 C13 C18 C17 174.2(3) . . . . ?
N11 P12 C19 C20 150.8(3) . . . . ?
C13 P12 C19 C20 -98.3(3) . . . . ?
Ag1 P12 C19 C20 28.6(4) . . . . ?
N11 P12 C19 C24 -29.0(4) . . . . ?
C13 P12 C19 C24 81.8(4) . . . . ?
Ag1 P12 C19 C24 -151.2(3) . . . . ?
C24 C19 C20 C21 0.1(6) . . . . ?
P12 C19 C20 C21 -179.7(3) . . . . ?
C19 C20 C21 C22 1.1(7) . . . . ?
C20 C21 C22 C23 -1.3(7) . . . . ?
C21 C22 C23 C24 0.4(7) . . . . ?
C22 C23 C24 C19 0.8(7) . . . . ?
C20 C19 C24 C23 -1.1(6) . . . . ?
P12 C19 C24 C23 178.8(3) . . . . ?
N12 P13 C25 C30 -111.7(3) . . . . ?
C31 P13 C25 C30 139.2(3) . . . . ?
Ag1 P13 C25 C30 6.8(4) . . . . ?
N12 P13 C25 C26 65.1(3) . . . . ?
C31 P13 C25 C26 -44.1(3) . . . . ?
Ag1 P13 C25 C26 -176.4(3) . . . . ?
C30 C25 C26 C27 -0.5(6) . . . . ?
P13 C25 C26 C27 -177.2(3) . . . . ?
C25 C26 C27 C28 -0.6(6) . . . . ?
C26 C27 C28 C29 1.3(7) . . . . ?
C27 C28 C29 C30 -0.9(8) . . . . ?
C28 C29 C30 C25 -0.2(7) . . . . ?
C26 C25 C30 C29 0.9(6) . . . . ?
P13 C25 C30 C29 177.8(4) . . . . ?
N12 P13 C31 C36 145.3(3) . . . . ?
C25 P13 C31 C36 -104.4(3) . . . . ?
Ag1 P13 C31 C36 30.3(3) . . . . ?
N12 P13 C31 C32 -32.0(4) . . . . ?
C25 P13 C31 C32 78.3(3) . . . . ?
Ag1 P13 C31 C32 -146.9(3) . . . . ?
C36 C31 C32 C33 1.9(6) . . . . ?
P13 C31 C32 C33 179.0(3) . . . . ?
C31 C32 C33 C34 -0.9(6) . . . . ?
C32 C33 C34 C35 -0.1(6) . . . . ?
C33 C34 C35 C36 0.2(7) . . . . ?
C34 C35 C36 C31 0.8(7) . . . . ?
C32 C31 C36 C35 -1.8(6) . . . . ?
P13 C31 C36 C35 -179.2(3) . . . . ?
N12 P14 C37 C42 -46.3(3) . . . . ?
C43 P14 C37 C42 65.6(3) . . . . ?
Se12 P14 C37 C42 -172.3(3) . . . . ?
N12 P14 C37 C38 132.9(3) . . . . ?
C43 P14 C37 C38 -115.2(3) . . . . ?
Se12 P14 C37 C38 6.8(3) . . . . ?
C42 C37 C38 C39 0.3(5) . . . . ?
P14 C37 C38 C39 -178.8(3) . . . . ?
C37 C38 C39 C40 -0.3(5) . . . . ?
C38 C39 C40 C41 0.0(6) . . . . ?
C39 C40 C41 C42 0.2(6) . . . . ?
C40 C41 C42 C37 -0.1(6) . . . . ?
C38 C37 C42 C41 -0.1(6) . . . . ?
P14 C37 C42 C41 179.0(3) . . . . ?
N12 P14 C43 C48 -39.6(3) . . . . ?
C37 P14 C43 C48 -153.5(3) . . . . ?
Se12 P14 C43 C48 82.9(3) . . . . ?
N12 P14 C43 C44 148.9(3) . . . . ?
C37 P14 C43 C44 35.0(3) . . . . ?
Se12 P14 C43 C44 -88.6(3) . . . . ?
C48 C43 C44 C45 0.4(6) . . . . ?
P14 C43 C44 C45 172.1(3) . . . . ?
C43 C44 C45 C46 -1.7(6) . . . . ?
C44 C45 C46 C47 1.8(6) . . . . ?
C45 C46 C47 C48 -0.5(6) . . . . ?
C46 C47 C48 C43 -0.8(6) . . . . ?
C44 C43 C48 C47 0.9(5) . . . . ?
P14 C43 C48 C47 -170.7(3) . . . . ?
P23 Ag2 Se21 P21 116.23(4) . . . . ?
P22 Ag2 Se21 P21 -32.89(4) . . . . ?
Se22 Ag2 Se21 P21 -135.13(3) . . . . ?
P23 Ag2 Se22 P24 14.21(3) . . . . ?
P22 Ag2 Se22 P24 154.26(3) . . . . ?
Se21 Ag2 Se22 P24 -110.50(3) . . . . ?
Ag2 Se21 P21 N21 52.65(13) . . . . ?
Ag2 Se21 P21 C55 173.42(13) . . . . ?
Ag2 Se21 P21 C49 -68.62(13) . . . . ?
P23 Ag2 P22 N21 -122.11(12) . . . . ?
Se22 Ag2 P22 N21 131.16(12) . . . . ?
Se21 Ag2 P22 N21 16.28(12) . . . . ?
P23 Ag2 P22 C67 -0.33(17) . . . . ?
Se22 Ag2 P22 C67 -107.06(15) . . . . ?
Se21 Ag2 P22 C67 138.05(15) . . . . ?
P23 Ag2 P22 C61 125.95(13) . . . . ?
Se22 Ag2 P22 C61 19.23(13) . . . . ?
Se21 Ag2 P22 C61 -95.66(13) . . . . ?
P22 Ag2 P23 N22 -103.58(12) . . . . ?
Se22 Ag2 P23 N22 6.22(11) . . . . ?
Se21 Ag2 P23 N22 126.44(11) . . . . ?
P22 Ag2 P23 C79 11.32(15) . . . . ?
Se22 Ag2 P23 C79 121.11(13) . . . . ?
Se21 Ag2 P23 C79 -118.66(13) . . . . ?
P22 Ag2 P23 C73 139.10(13) . . . . ?
Se22 Ag2 P23 C73 -111.10(13) . . . . ?
Se21 Ag2 P23 C73 9.12(13) . . . . ?
Ag2 Se22 P24 N22 -35.76(12) . . . . ?
Ag2 Se22 P24 C91 -152.31(13) . . . . ?
Ag2 Se22 P24 C85 86.86(12) . . . . ?
C55 P21 N21 P22 -179.0(2) . . . . ?
C49 P21 N21 P22 70.0(2) . . . . ?
Se21 P21 N21 P22 -54.1(2) . . . . ?
C67 P22 N21 P21 -117.8(2) . . . . ?
C61 P22 N21 P21 131.8(2) . . . . ?
Ag2 P22 N21 P21 15.5(2) . . . . ?
C91 P24 N22 P23 173.4(2) . . . . ?
C85 P24 N22 P23 -72.5(2) . . . . ?
Se22 P24 N22 P23 52.9(2) . . . . ?
C79 P23 N22 P24 -158.4(2) . . . . ?
C73 P23 N22 P24 91.5(2) . . . . ?
Ag2 P23 N22 P24 -34.4(2) . . . . ?
N21 P21 C49 C54 -156.0(3) . . . . ?
C55 P21 C49 C54 92.5(3) . . . . ?
Se21 P21 C49 C54 -30.4(3) . . . . ?
N21 P21 C49 C50 30.1(4) . . . . ?
C55 P21 C49 C50 -81.4(3) . . . . ?
Se21 P21 C49 C50 155.7(3) . . . . ?
C54 C49 C50 C51 -0.8(6) . . . . ?
P21 C49 C50 C51 173.1(4) . . . . ?
C49 C50 C51 C52 -1.2(7) . . . . ?
C50 C51 C52 C53 2.2(8) . . . . ?
C51 C52 C53 C54 -1.1(8) . . . . ?
C50 C49 C54 C53 1.9(6) . . . . ?
P21 C49 C54 C53 -172.0(3) . . . . ?
C52 C53 C54 C49 -1.0(7) . . . . ?
N21 P21 C55 C60 142.5(3) . . . . ?
C49 P21 C55 C60 -105.1(3) . . . . ?
Se21 P21 C55 C60 16.9(4) . . . . ?
N21 P21 C55 C56 -43.1(4) . . . . ?
C49 P21 C55 C56 69.3(4) . . . . ?
Se21 P21 C55 C56 -168.7(3) . . . . ?
C60 C55 C56 C57 -1.3(6) . . . . ?
P21 C55 C56 C57 -175.7(3) . . . . ?
C55 C56 C57 C58 1.7(7) . . . . ?
C56 C57 C58 C59 -1.3(7) . . . . ?
C57 C58 C59 C60 0.5(7) . . . . ?
C56 C55 C60 C59 0.4(6) . . . . ?
P21 C55 C60 C59 174.9(3) . . . . ?
C58 C59 C60 C55 0.0(7) . . . . ?
N21 P22 C61 C66 131.7(3) . . . . ?
C67 P22 C61 C66 21.0(4) . . . . ?
Ag2 P22 C61 C66 -115.4(3) . . . . ?
N21 P22 C61 C62 -55.2(3) . . . . ?
C67 P22 C61 C62 -165.9(3) . . . . ?
Ag2 P22 C61 C62 57.6(3) . . . . ?
C66 C61 C62 C63 -0.4(6) . . . . ?
P22 C61 C62 C63 -173.7(3) . . . . ?
C61 C62 C63 C64 0.0(7) . . . . ?
C62 C63 C64 C65 0.5(7) . . . . ?
C63 C64 C65 C66 -0.5(7) . . . . ?
C64 C65 C66 C61 0.1(7) . . . . ?
C62 C61 C66 C65 0.4(6) . . . . ?
P22 C61 C66 C65 173.4(3) . . . . ?
N21 P22 C67 C72 133.5(4) . . . . ?
C61 P22 C67 C72 -116.7(4) . . . . ?
Ag2 P22 C67 C72 11.7(4) . . . . ?
N21 P22 C67 C68 -45.2(4) . . . . ?
C61 P22 C67 C68 64.5(4) . . . . ?
Ag2 P22 C67 C68 -167.0(3) . . . . ?
C72 C67 C68 C69 0.6(7) . . . . ?
P22 C67 C68 C69 179.4(4) . . . . ?
C67 C68 C69 C70 -0.3(8) . . . . ?
C68 C69 C70 C71 0.2(10) . . . . ?
C69 C70 C71 C72 -0.5(11) . . . . ?
C68 C67 C72 C71 -0.9(8) . . . . ?
P22 C67 C72 C71 -179.7(5) . . . . ?
C70 C71 C72 C67 0.8(10) . . . . ?
N22 P23 C73 C78 -123.1(3) . . . . ?
C79 P23 C73 C78 127.7(3) . . . . ?
Ag2 P23 C73 C78 -5.8(3) . . . . ?
N22 P23 C73 C74 51.3(3) . . . . ?
C79 P23 C73 C74 -58.0(3) . . . . ?
Ag2 P23 C73 C74 168.6(3) . . . . ?
C78 C73 C74 C75 -0.3(6) . . . . ?
P23 C73 C74 C75 -174.7(3) . . . . ?
C73 C74 C75 C76 0.6(6) . . . . ?
C74 C75 C76 C77 -0.5(6) . . . . ?
C75 C76 C77 C78 0.2(7) . . . . ?
C74 C73 C78 C77 0.0(6) . . . . ?
P23 C73 C78 C77 174.6(4) . . . . ?
C76 C77 C78 C73 0.1(7) . . . . ?
N22 P23 C79 C80 7.0(4) . . . . ?
C73 P23 C79 C80 117.3(4) . . . . ?
Ag2 P23 C79 C80 -108.7(3) . . . . ?
N22 P23 C79 C84 -178.3(4) . . . . ?
C73 P23 C79 C84 -68.0(4) . . . . ?
Ag2 P23 C79 C84 66.1(4) . . . . ?
C84 C79 C80 C81 -1.2(6) . . . . ?
P23 C79 C80 C81 173.4(3) . . . . ?
C79 C80 C81 C82 0.5(7) . . . . ?
C80 C81 C82 C83 0.6(7) . . . . ?
C81 C82 C83 C84 -1.0(9) . . . . ?
C80 C79 C84 C83 0.9(8) . . . . ?
P23 C79 C84 C83 -174.2(5) . . . . ?
C82 C83 C84 C79 0.2(9) . . . . ?
N22 P24 C85 C86 131.6(3) . . . . ?
C91 P24 C85 C86 -117.0(3) . . . . ?
Se22 P24 C85 C86 5.5(3) . . . . ?
N22 P24 C85 C90 -45.9(3) . . . . ?
C91 P24 C85 C90 65.5(3) . . . . ?
Se22 P24 C85 C90 -172.0(2) . . . . ?
C90 C85 C86 C87 -0.3(6) . . . . ?
P24 C85 C86 C87 -177.7(3) . . . . ?
C85 C86 C87 C88 1.1(6) . . . . ?
C86 C87 C88 C89 -1.6(6) . . . . ?
C87 C88 C89 C90 1.3(7) . . . . ?
C88 C89 C90 C85 -0.6(6) . . . . ?
C86 C85 C90 C89 0.1(6) . . . . ?
P24 C85 C90 C89 177.5(3) . . . . ?
N22 P24 C91 C92 -42.1(3) . . . . ?
C85 P24 C91 C92 -155.9(3) . . . . ?
Se22 P24 C91 C92 80.4(3) . . . . ?
N22 P24 C91 C96 144.9(3) . . . . ?
C85 P24 C91 C96 31.1(3) . . . . ?
Se22 P24 C91 C96 -92.6(3) . . . . ?
C96 C91 C92 C93 -0.1(6) . . . . ?
P24 C91 C92 C93 -173.1(3) . . . . ?
C91 C92 C93 C94 0.8(6) . . . . ?
C92 C93 C94 C95 -1.3(6) . . . . ?
C93 C94 C95 C96 0.9(6) . . . . ?
C94 C95 C96 C91 -0.2(6) . . . . ?
C92 C91 C96 C95 -0.2(6) . . . . ?
P24 C91 C96 C95 172.8(3) . . . . ?
