#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/89/4318998.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_4318998
loop_
_publ_author_name
'Augusto Cingolani'
Effendy
'Maura Pellei'
'Claudio Pettinari'
'Carlo Santini'
'Brian W. Skelton'
'Allan H. White'
_publ_contact_author_address
;
  Department of Chemistry
  University of Western Australia
  35 Stirling Highway
  Crawley
  Western Australia 6009
  Australia
;
_publ_contact_author_email       bws@crystal.uwa.edu.au
_publ_contact_author_fax         (+61)_08_9380_1118
_publ_contact_author_name        'Skelton, B. W.'
_publ_contact_author_phone       (+61)_08-9380_3481
_publ_section_title
;
 Variable Coordination Modes of NO2- in a Series of Ag(I) Complexes
 Containing Triorganophosphines, -arsines, and -stibines. Syntheses,
 Spectroscopic Characterization (IR, 1H and 31P NMR, Electrospray
 Ionization Mass), and Structures of [AgNO2(R3E)x] Adducts (E = P, As, Sb,
 x = 1-3)
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              6633
_journal_page_last               6645
_journal_paper_doi               10.1021/ic020375g
_journal_volume                  41
_journal_year                    2002
_chemical_formula_sum            'C36 H66 Ag N O2 P2'
_chemical_formula_weight         714.75
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                94.530(10)
_cell_angle_beta                 96.670(10)
_cell_angle_gamma                116.11(2)
_cell_formula_units_Z            2
_cell_length_a                   9.105(4)
_cell_length_b                   9.821(2)
_cell_length_c                   23.437(3)
_cell_measurement_reflns_used    8
_cell_measurement_temperature    293
_cell_measurement_theta_max      18.6
_cell_measurement_theta_min      11.7
_cell_volume                     1849.1(10)
_computing_cell_refinement       'Enraf Nonius software'
_computing_data_collection       'Enraf Nonius software'
_computing_data_reduction        xtal
_computing_molecular_graphics    xtal
_computing_publication_material  'xtal BONDLA CIFIO'
_computing_structure_refinement  xtal
_computing_structure_solution    xtal
_diffrn_ambient_temperature      293
_diffrn_measurement_device_type
;
  CAD4  diffractometer
;
_diffrn_measurement_method       '2θ-ω scans'
_diffrn_radiation_detector       'scintillation counter'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     .71073
_diffrn_reflns_av_R_equivalents  .0328
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            10672
_diffrn_reflns_theta_max         25
_diffrn_standards_decay_%        0
_diffrn_standards_interval_time  60
_diffrn_standards_number         8
_exptl_absorpt_coefficient_mu    .662
_exptl_absorpt_correction_T_max  .90
_exptl_absorpt_correction_T_min  .80
_exptl_absorpt_correction_type   gaussian
_exptl_absorpt_process_details
;
XTAL absorb
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.284
_exptl_crystal_description       plate
_exptl_crystal_F_000             764
_exptl_crystal_size_max          .40
_exptl_crystal_size_mid          .36
_exptl_crystal_size_min          .16
_refine_diff_density_max         .67
_refine_diff_density_min         -.89
_refine_ls_goodness_of_fit_all   1.87
_refine_ls_goodness_of_fit_ref   1.97
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     407
_refine_ls_number_reflns         5416
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          .050
_refine_ls_R_factor_gt           .042
_refine_ls_shift/su_max          .043
_refine_ls_shift/su_mean         .0089
_refine_ls_structure_factor_coef F
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_all         .051
_refine_ls_wR_factor_ref         .049
_reflns_limit_h_max              9
_reflns_limit_h_min              0
_reflns_limit_k_max              10
_reflns_limit_k_min              -10
_reflns_limit_l_max              27
_reflns_limit_l_min              -27
_reflns_number_gt                5416
_reflns_number_observed          5416
_reflns_number_total             6484
_reflns_threshold_expression     'I    > 3.00 sig(I   )'
_cod_data_source_file            ic020375g_06.cif
_cod_data_source_block           cyago2
_cod_original_sg_symbol_Hall     -p_1
_cod_original_formula_sum        'C36 H66 Ag1 N1 O2 P2'
_cod_database_code               4318998
loop_
_symmetry_equiv_pos_as_xyz
+x,+y,+z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_calc_attached_atom
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag .04018(6) .343860(10) .252420(10) .04124(16) Uani ? ? 1.00000 ? ?
N -.2921(6) .3317(7) .2427(2) .085(3) Uani ? ? 1.00000 ? ?
O1 -.1598(5) .4456(5) .2600(2) .093(2) Uani ? ? 1.00000 ? ?
O2 -.2736(5) .2189(5) .2295(2) .096(2) Uani ? ? 1.00000 ? ?
P1 .14952(13) .39119(12) .16097(4) .0379(4) Uani ? ? 1.00000 ? ?
C111 .0170(5) .4219(5) .10266(17) .0408(18) Uani ? ? 1.00000 ? ?
C112 -.1509(5) .2806(5) .08436(19) .052(2) Uani ? ? 1.00000 ? ?
C113 -.2626(6) .3088(6) .0383(2) .062(2) Uani ? ? 1.00000 ? ?
C114 -.2853(6) .4490(7) .0580(2) .069(3) Uani ? ? 1.00000 ? ?
C115 -.1181(6) .5884(6) .0749(2) .062(2) Uani ? ? 1.00000 ? ?
C116 -.0071(5) .5632(5) .12223(19) .050(2) Uani ? ? 1.00000 ? ?
C121 .1687(5) .2213(5) .12914(18) .0431(18) Uani ? ? 1.00000 ? ?
C122 .2788(6) .1817(5) .17204(19) .058(2) Uani ? ? 1.00000 ? ?
C123 .2729(7) .0289(6) .1515(2) .068(3) Uani ? ? 1.00000 ? ?
C124 .3191(7) .0252(6) .0920(2) .072(3) Uani ? ? 1.00000 ? ?
C125 .2144(7) .0661(6) .0488(2) .071(3) Uani ? ? 1.00000 ? ?
C126 .2174(6) .2195(5) .06978(19) .057(2) Uani ? ? 1.00000 ? ?
C131 .3599(5) .5550(5) .16870(18) .0439(19) Uani ? ? 1.00000 ? ?
C132 .3907(6) .6836(5) .21680(19) .054(2) Uani ? ? 1.00000 ? ?
C133 .5686(6) .8074(6) .2281(2) .070(3) Uani ? ? 1.00000 ? ?
C134 .6230(6) .8711(5) .1732(2) .065(2) Uani ? ? 1.00000 ? ?
C135 .5930(6) .7458(6) .1252(2) .069(3) Uani ? ? 1.00000 ? ?
C136 .4125(6) .6233(5) .1141(2) .055(2) Uani ? ? 1.00000 ? ?
P2 .14019(13) .27707(12) .34293(4) .0385(5) Uani ? ? 1.00000 ? ?
C211 -.0011(6) .2379(7) .3966(2) .070(3) Uani ? ? 1.00000 ? ?
C212 .0641(6) .2438(6) .4599(2) .062(2) Uani ? ? 1.00000 ? ?
C213A -.050(2) .253(2) .5023(8) .094(8) Uani ? ? .50000 ? ?
C214A -.231(2) .167(2) .4793(9) .079(8) Uani ? ? .50000 ? ?
C215 -.2717(7) .2017(8) .4219(3) .094(4) Uani ? ? 1.00000 ? ?
C216A -.1706(14) .170(2) .3783(6) .100(7) Uani ? ? .50000 ? ?
C213B -.075(2) .1665(17) .4933(7) .067(7) Uani ? ? .50000 ? ?
C214B -.180(2) .2459(19) .4890(9) .073(9) Uani ? ? .50000 ? ?
C216B -.1230(14) .2926(14) .3876(5) .064(6) Uani ? ? .50000 ? ?
C221 .3475(5) .4209(5) .38170(17) .0402(17) Uani ? ? 1.00000 ? ?
C222 .4821(5) .4429(5) .3450(2) .053(2) Uani ? ? 1.00000 ? ?
C223 .6511(6) .5641(6) .3761(3) .070(3) Uani ? ? 1.00000 ? ?
C224 .6503(6) .7155(5) .3936(2) .066(2) Uani ? ? 1.00000 ? ?
C225 .5184(6) .6955(5) .4301(2) .062(2) Uani ? ? 1.00000 ? ?
C226 .3487(6) .5744(5) .3989(2) .054(2) Uani ? ? 1.00000 ? ?
C231 .1661(5) .1017(5) .32771(18) .0449(18) Uani ? ? 1.00000 ? ?
C232 .0098(6) -.0305(5) .2922(2) .058(2) Uani ? ? 1.00000 ? ?
C233 .0383(6) -.1661(5) .2723(2) .066(2) Uani ? ? 1.00000 ? ?
C234 .1117(7) -.2188(6) .3218(3) .068(3) Uani ? ? 1.00000 ? ?
C235 .2661(7) -.0874(6) .3559(2) .068(3) Uani ? ? 1.00000 ? ?
C236 .2359(6) .0469(5) .3781(2) .059(2) Uani ? ? 1.00000 ? ?
H111 .07171 .44023 .06975 .05440 Uiso ? ? 1.00000 ? ?
H112a -.20385 .25580 .11748 .06570 Uiso ? ? 1.00000 ? ?
H112e -.13385 .19664 .06934 .06570 Uiso ? ? 1.00000 ? ?
H113a -.21400 .32432 .00395 .07830 Uiso ? ? 1.00000 ? ?
H113e -.36821 .22111 .02977 .07830 Uiso ? ? 1.00000 ? ?
H114a -.34098 .43105 .09068 .09600 Uiso ? ? 1.00000 ? ?
H114e -.35009 .46635 .02737 .09600 Uiso ? ? 1.00000 ? ?
H115a -.06546 .60886 .04162 .09010 Uiso ? ? 1.00000 ? ?
H115e -.13400 .67395 .08853 .09010 Uiso ? ? 1.00000 ? ?
H116a -.05699 .54768 .15624 .06860 Uiso ? ? 1.00000 ? ?
H116e .09801 .65141 .13092 .06860 Uiso ? ? 1.00000 ? ?
H121 .05634 .14373 .12196 .05770 Uiso ? ? 1.00000 ? ?
H122a .39041 .25986 .17636 .08290 Uiso ? ? 1.00000 ? ?
H122e .24272 .17805 .20861 .08290 Uiso ? ? 1.00000 ? ?
H123a .16352 -.05009 .15024 .09840 Uiso ? ? 1.00000 ? ?
H123e .34828 .01194 .17806 .09840 Uiso ? ? 1.00000 ? ?
H124a .43234 .09661 .09428 .10180 Uiso ? ? 1.00000 ? ?
H124e .30401 -.07494 .07908 .10180 Uiso ? ? 1.00000 ? ?
H125a .10285 -.01231 .04292 .09680 Uiso ? ? 1.00000 ? ?
H125e .25507 .07253 .01304 .09680 Uiso ? ? 1.00000 ? ?
H126a .32670 .29981 .07165 .07830 Uiso ? ? 1.00000 ? ?
H126e .14245 .23626 .04293 .07830 Uiso ? ? 1.00000 ? ?
H131 .42888 .50759 .17869 .05730 Uiso ? ? 1.00000 ? ?
H132a .31966 .72834 .20584 .06490 Uiso ? ? 1.00000 ? ?
H132e .36480 .64116 .25164 .06490 Uiso ? ? 1.00000 ? ?
H133a .63854 .76516 .24304 .08100 Uiso ? ? 1.00000 ? ?
H133e .57891 .88831 .25589 .08100 Uiso ? ? 1.00000 ? ?
H134a .56237 .92453 .16076 .07790 Uiso ? ? 1.00000 ? ?
H134e .73825 .94068 .18130 .07790 Uiso ? ? 1.00000 ? ?
H135a .66273 .69972 .13582 .08610 Uiso ? ? 1.00000 ? ?
H135e .61939 .78911 .09056 .08610 Uiso ? ? 1.00000 ? ?
H136a .34355 .66853 .10099 .06780 Uiso ? ? 1.00000 ? ?
H136e .39897 .54404 .08488 .06780 Uiso ? ? 1.00000 ? ?
H211A .00439 .33739 .39973 .04750 Uiso ? ? .50000 ? ?
H212Aa .07970 .15541 .46372 .04060 Uiso ? ? .50000 ? ?
H212Ae .16910 .33301 .47056 .04060 Uiso ? ? .50000 ? ?
H213Aa -.02227 .35656 .51333 .10470 Uiso ? ? .50000 ? ?
H213Ae -.02825 .21019 .53588 .10470 Uiso ? ? .50000 ? ?
H214Aa -.26414 .06030 .47620 .09040 Uiso ? ? .50000 ? ?
H214Ae -.28927 .19459 .50494 .09040 Uiso ? ? .50000 ? ?
H215Aa -.24712 .30701 .42500 .06670 Uiso ? ? .50000 ? ?
H215Ae -.38687 .14021 .40784 .06670 Uiso ? ? .50000 ? ?
H216Aa -.20576 .06075 .37137 .10840 Uiso ? ? .50000 ? ?
H216Ae -.19041 .20231 .34259 .10840 Uiso ? ? .50000 ? ?
H211B -.06312 .12983 .38546 .04750 Uiso ? ? .50000 ? ?
H212Ba .12841 .34861 .47719 .04060 Uiso ? ? .50000 ? ?
H212Be .13359 .19434 .46194 .04060 Uiso ? ? .50000 ? ?
H213Ba -.13968 .06179 .47670 .08220 Uiso ? ? .50000 ? ?
H213Be -.03224 .17248 .53280 .08220 Uiso ? ? .50000 ? ?
H214Ba -.11294 .35354 .49892 .08900 Uiso ? ? .50000 ? ?
H214Be -.25868 .21157 .51463 .08900 Uiso ? ? .50000 ? ?
H215Ba -.32086 .09440 .40972 .06670 Uiso ? ? .50000 ? ?
H215Be -.35444 .23611 .41649 .06670 Uiso ? ? .50000 ? ?
H216Ba -.07259 .39864 .40172 .09240 Uiso ? ? .50000 ? ?
H216Be -.16465 .27553 .34731 .09240 Uiso ? ? .50000 ? ?
H221 .37113 .38326 .41608 .05060 Uiso ? ? 1.00000 ? ?
H222a .45531 .47395 .30933 .06590 Uiso ? ? 1.00000 ? ?
H222e .48634 .34836 .33683 .06590 Uiso ? ? 1.00000 ? ?
H223a .68121 .52910 .41019 .08250 Uiso ? ? 1.00000 ? ?
H223e .73044 .57898 .35125 .08250 Uiso ? ? 1.00000 ? ?
H224a .62875 .75504 .35944 .07580 Uiso ? ? 1.00000 ? ?
H224e .75596 .78615 .41501 .07580 Uiso ? ? 1.00000 ? ?
H225a .54519 .66424 .46574 .07470 Uiso ? ? 1.00000 ? ?
H225e .51522 .79042 .43829 .07470 Uiso ? ? 1.00000 ? ?
H226a .31919 .60947 .36469 .06880 Uiso ? ? 1.00000 ? ?
H226e .26924 .56086 .42370 .06880 Uiso ? ? 1.00000 ? ?
H231 .25312 .13567 .30513 .05650 Uiso ? ? 1.00000 ? ?
H232a -.07501 -.06256 .31566 .07010 Uiso ? ? 1.00000 ? ?
H232e -.02566 .00442 .25912 .07010 Uiso ? ? 1.00000 ? ?
H233a .11259 -.13730 .24507 .08020 Uiso ? ? 1.00000 ? ?
H233e -.06461 -.24868 .25408 .08020 Uiso ? ? 1.00000 ? ?
H234a .03251 -.25949 .34677 .08870 Uiso ? ? 1.00000 ? ?
H234e .13836 -.29622 .30664 .08870 Uiso ? ? 1.00000 ? ?
H235a .34820 -.05284 .33152 .08990 Uiso ? ? 1.00000 ? ?
H235e .30543 -.12233 .38812 .08990 Uiso ? ? 1.00000 ? ?
H236a .15887 .01482 .40426 .07650 Uiso ? ? 1.00000 ? ?
H236e .33774 .12858 .39777 .07650 Uiso ? ? 1.00000 ? ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_oxidation_number
_atom_type_number_in_cell
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C ? 0 72 .002 .002 'Int Tables Vol IV Tables 2.2B and 2.3.1'
H ? 0 132 0 0 'Int Tables Vol IV Tables 2.2B and 2.3.1'
Ag ? 0 2 -1.085 1.101 'Int Tables Vol IV Tables 2.2B and 2.3.1'
P ? 0 4 .09 .095 'Int Tables Vol IV Tables 2.2B and 2.3.1'
N ? 0 2 .004 .003 'Int Tables Vol IV Tables 2.2B and 2.3.1'
O ? 0 4 .008 .006 'Int Tables Vol IV Tables 2.2B and 2.3.1'
loop_
_diffrn_attenuator_code
_diffrn_attenuator_scale
? ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
10 4 3
-10 -4 -3
20 0 0
-20 0 0
0 5 0
0 -5 0
0 0 6
0 0 -6
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
O1 Ag O2 . . . 47.88(14) ?
O1 Ag P1 . . . 110.47(12) ?
O1 Ag P2 . . . 115.47(12) ?
O2 Ag P1 . . . 108.52(11) ?
O2 Ag P2 . . . 111.97(11) ?
P1 Ag P2 . . . 132.03(5) ?
O1 N O2 . . . 112.1(6) ?
Ag O1 N . . . 102.0(5) ?
Ag O2 N . . . 98.0(3) ?
Ag P1 C111 . . . 115.29(15) ?
Ag P1 C121 . . . 110.03(14) ?
Ag P1 C131 . . . 114.46(14) ?
C111 P1 C121 . . . 104.2(2) ?
C111 P1 C131 . . . 106.5(2) ?
C121 P1 C131 . . . 105.5(2) ?
P1 C111 C112 . . . 111.5(3) ?
P1 C111 C116 . . . 110.4(3) ?
P1 C111 H111 . . . 108.0 ?
C112 C111 C116 . . . 110.4(4) ?
C112 C111 H111 . . . 107.8 ?
C116 C111 H111 . . . 108.6 ?
C111 C112 C113 . . . 111.3(4) ?
C111 C112 H112a . . . 109.0 ?
C111 C112 H112e . . . 109.2 ?
C113 C112 H112a . . . 109.0 ?
C113 C112 H112e . . . 109.3 ?
H112a C112 H112e . . . 109.0 ?
C112 C113 C114 . . . 112.0(4) ?
C112 C113 H113a . . . 108.8 ?
C112 C113 H113e . . . 109.0 ?
C114 C113 H113a . . . 108.9 ?
C114 C113 H113e . . . 109.1 ?
H113a C113 H113e . . . 109.1 ?
C113 C114 C115 . . . 110.0(5) ?
C113 C114 H114a . . . 109.2 ?
C113 C114 H114e . . . 109.5 ?
C115 C114 H114a . . . 109.3 ?
C115 C114 H114e . . . 109.5 ?
H114a C114 H114e . . . 109.3 ?
C114 C115 C116 . . . 111.4(5) ?
C114 C115 H115a . . . 108.9 ?
C114 C115 H115e . . . 109.1 ?
C116 C115 H115a . . . 109.0 ?
C116 C115 H115e . . . 109.2 ?
H115a C115 H115e . . . 109.3 ?
C111 C116 C115 . . . 110.9(4) ?
C111 C116 H116a . . . 109.1 ?
C111 C116 H116e . . . 109.3 ?
C115 C116 H116a . . . 109.2 ?
C115 C116 H116e . . . 109.3 ?
H116a C116 H116e . . . 109.1 ?
P1 C121 C122 . . . 110.9(3) ?
P1 C121 C126 . . . 118.8(3) ?
P1 C121 H121 . . . 102.1 ?
C122 C121 C126 . . . 110.2(4) ?
C122 C121 H121 . . . 111.9 ?
C126 C121 H121 . . . 102.3 ?
C121 C122 C123 . . . 111.9(4) ?
C121 C122 H122a . . . 108.8 ?
C121 C122 H122e . . . 109.0 ?
C123 C122 H122a . . . 108.9 ?
C123 C122 H122e . . . 109.1 ?
H122a C122 H122e . . . 109.1 ?
C122 C123 C124 . . . 111.3(5) ?
C122 C123 H123a . . . 108.9 ?
C122 C123 H123e . . . 109.2 ?
C124 C123 H123a . . . 109.1 ?
C124 C123 H123e . . . 109.0 ?
H123a C123 H123e . . . 109.3 ?
C123 C124 C125 . . . 111.8(6) ?
C123 C124 H124a . . . 108.9 ?
C123 C124 H124e . . . 109.0 ?
C125 C124 H124a . . . 108.8 ?
C125 C124 H124e . . . 108.9 ?
H124a C124 H124e . . . 109.5 ?
C124 C125 C126 . . . 112.1(4) ?
C124 C125 H125a . . . 108.8 ?
C124 C125 H125e . . . 108.9 ?
C126 C125 H125a . . . 108.7 ?
C126 C125 H125e . . . 109.0 ?
H125a C125 H125e . . . 109.3 ?
C121 C126 C125 . . . 111.4(4) ?
C121 C126 H126a . . . 108.9 ?
C121 C126 H126e . . . 109.2 ?
C125 C126 H126a . . . 109.0 ?
C125 C126 H126e . . . 109.2 ?
H126a C126 H126e . . . 109.2 ?
P1 C131 C132 . . . 112.6(3) ?
P1 C131 C136 . . . 117.1(3) ?
P1 C131 H131 . . . 101.6 ?
C132 C131 C136 . . . 109.2(4) ?
C132 C131 H131 . . . 110.6 ?
C136 C131 H131 . . . 105.1 ?
C131 C132 C133 . . . 112.4(4) ?
C131 C132 H132a . . . 108.8 ?
C131 C132 H132e . . . 108.8 ?
C133 C132 H132a . . . 108.9 ?
C133 C132 H132e . . . 108.8 ?
H132a C132 H132e . . . 109.1 ?
C132 C133 C134 . . . 111.7(4) ?
C132 C133 H133a . . . 108.9 ?
C132 C133 H133e . . . 109.1 ?
C134 C133 H133a . . . 108.8 ?
C134 C133 H133e . . . 109.0 ?
H133a C133 H133e . . . 109.4 ?
C133 C134 C135 . . . 111.6(4) ?
C133 C134 H134a . . . 108.9 ?
C133 C134 H134e . . . 109.0 ?
C135 C134 H134a . . . 109.1 ?
C135 C134 H134e . . . 109.1 ?
H134a C134 H134e . . . 109.1 ?
C134 C135 C136 . . . 111.3(5) ?
C134 C135 H135a . . . 109.1 ?
C134 C135 H135e . . . 109.1 ?
C136 C135 H135a . . . 109.1 ?
C136 C135 H135e . . . 109.1 ?
H135a C135 H135e . . . 109.2 ?
C131 C136 C135 . . . 111.7(4) ?
C131 C136 H136a . . . 108.8 ?
C131 C136 H136e . . . 109.1 ?
C135 C136 H136a . . . 108.8 ?
C135 C136 H136e . . . 109.1 ?
H136a C136 H136e . . . 109.3 ?
Ag P2 C211 . . . 114.0(2) ?
Ag P2 C221 . . . 115.28(14) ?
Ag P2 C231 . . . 110.50(13) ?
C211 P2 C221 . . . 106.3(2) ?
C211 P2 C231 . . . 106.2(3) ?
C221 P2 C231 . . . 103.7(2) ?
P2 C211 C212 . . . 119.7(4) ?
P2 C211 C216A . . . 120.2(6) ?
P2 C211 C216B . . . 115.6(6) ?
P2 C211 H211A . . . 94.0 ?
P2 C211 H211B . . . 98.2 ?
C212 C211 C216A . . . 118.5(7) ?
C212 C211 C216B . . . 114.7(7) ?
C212 C211 H211A . . . 97.5 ?
C212 C211 H211B . . . 100.0 ?
C216A C211 H211A . . . 91.3 ?
C216B C211 H211B . . . 103.9 ?
C211 C212 C213A . . . 114.2(9) ?
C211 C212 C213B . . . 111.6(7) ?
C211 C212 H212Aa . . . 108.7 ?
C211 C212 H212Ae . . . 108.0 ?
C211 C212 H212Ba . . . 109.0 ?
C211 C212 H212Be . . . 109.1 ?
C213A C212 H212Aa . . . 109.1 ?
C213A C212 H212Ae . . . 107.9 ?
C213B C212 H212Ba . . . 109.0 ?
C213B C212 H212Be . . . 109.3 ?
H212Aa C212 H212Ae . . . 109.0 ?
H212Ba C212 H212Be . . . 108.8 ?
C212 C213A C214A . . . 114.9(14) ?
C212 C213A H213Aa . . . 108.5 ?
C212 C213A H213Ae . . . 107 ?
C214A C213A H213Aa . . . 109 ?
C214A C213A H213Ae . . . 107.4 ?
H213Aa C213A H213Ae . . . 109.5 ?
C213A C214A C215 . . . 111.6(14) ?
C213A C214A H214Aa . . . 110 ?
C213A C214A H214Ae . . . 108.6 ?
C215 C214A H214Aa . . . 108.4 ?
C215 C214A H214Ae . . . 108.4 ?
H214Aa C214A H214Ae . . . 110.3 ?
C214A C215 C216A . . . 111.4(12) ?
C214A C215 H215Aa . . . 109.2 ?
C214A C215 H215Ae . . . 109.0 ?
C216A C215 H215Aa . . . 108.7 ?
C216A C215 H215Ae . . . 109.2 ?
C214B C215 H215Ba . . . 111.3 ?
C214B C215 H215Be . . . 111.0 ?
C216B C215 H215Ba . . . 111.4 ?
C216B C215 H215Be . . . 110.7 ?
H215Aa C215 H215Ae . . . 109.2 ?
H215Ba C215 H215Be . . . 109.4 ?
C211 C216A C215 . . . 115.3(9) ?
C211 C216A H216Aa . . . 106.0 ?
C211 C216A H216Ae . . . 107.6 ?
C215 C216A H216Aa . . . 108.9 ?
C215 C216A H216Ae . . . 110.3 ?
H216Aa C216A H216Ae . . . 108.4 ?
C212 C213B C214B . . . 107.6(13) ?
C212 C213B H213Ba . . . 109.8 ?
C212 C213B H213Be . . . 110.4 ?
C214B C213B H213Ba . . . 109.5 ?
C214B C213B H213Be . . . 110.2 ?
H213Ba C213B H213Be . . . 109.4 ?
C215 C214B C213B . . . 105.4(14) ?
C215 C214B H214Ba . . . 111.1 ?
C215 C214B H214Be . . . 110.8 ?
C213B C214B H214Ba . . . 110.3 ?
C213B C214B H214Be . . . 110.1 ?
H214Ba C214B H214Be . . . 109 ?
C211 C216B C215 . . . 109.3(9) ?
C211 C216B H216Ba . . . 108.8 ?
C211 C216B H216Be . . . 109.1 ?
C215 C216B H216Ba . . . 109.9 ?
C215 C216B H216Be . . . 109.7 ?
H216Ba C216B H216Be . . . 110.0 ?
P2 C221 C222 . . . 111.5(3) ?
P2 C221 C226 . . . 111.0(3) ?
P2 C221 H221 . . . 107.4 ?
C222 C221 C226 . . . 109.6(3) ?
C222 C221 H221 . . . 108.5 ?
C226 C221 H221 . . . 108.7 ?
C221 C222 C223 . . . 111.4(4) ?
C221 C222 H222a . . . 109.0 ?
C221 C222 H222e . . . 109.3 ?
C223 C222 H222a . . . 108.9 ?
C223 C222 H222e . . . 109.2 ?
H222a C222 H222e . . . 109.0 ?
C222 C223 C224 . . . 111.9(5) ?
C222 C223 H223a . . . 108.7 ?
C222 C223 H223e . . . 109.1 ?
C224 C223 H223a . . . 108.7 ?
C224 C223 H223e . . . 109.1 ?
H223a C223 H223e . . . 109.3 ?
C223 C224 C225 . . . 110.9(4) ?
C223 C224 H224a . . . 109.0 ?
C223 C224 H224e . . . 109.3 ?
C225 C224 H224a . . . 109.0 ?
C225 C224 H224e . . . 109.4 ?
H224a C224 H224e . . . 109.1 ?
C224 C225 C226 . . . 110.9(4) ?
C224 C225 H225a . . . 108.9 ?
C224 C225 H225e . . . 109.3 ?
C226 C225 H225a . . . 109.0 ?
C226 C225 H225e . . . 109.5 ?
H225a C225 H225e . . . 109.2 ?
C221 C226 C225 . . . 112.2(4) ?
C221 C226 H226a . . . 108.8 ?
C221 C226 H226e . . . 109.1 ?
C225 C226 H226a . . . 108.6 ?
C225 C226 H226e . . . 108.9 ?
H226a C226 H226e . . . 109.1 ?
P2 C231 C232 . . . 112.1(4) ?
P2 C231 C236 . . . 118.3(3) ?
P2 C231 H231 . . . 101.5 ?
C232 C231 C236 . . . 110.6(4) ?
C232 C231 H231 . . . 110.2 ?
C236 C231 H231 . . . 103.1 ?
C231 C232 C233 . . . 112.2(4) ?
C231 C232 H232a . . . 108.6 ?
C231 C232 H232e . . . 109.0 ?
C233 C232 H232a . . . 108.8 ?
C233 C232 H232e . . . 109.0 ?
H232a C232 H232e . . . 109.1 ?
C232 C233 C234 . . . 112.6(4) ?
C232 C233 H233a . . . 108.7 ?
C232 C233 H233e . . . 109.0 ?
C234 C233 H233a . . . 108.5 ?
C234 C233 H233e . . . 108.7 ?
H233a C233 H233e . . . 109.3 ?
C233 C234 C235 . . . 110.7(4) ?
C233 C234 H234a . . . 109.1 ?
C233 C234 H234e . . . 109.3 ?
C235 C234 H234a . . . 109.0 ?
C235 C234 H234e . . . 109.3 ?
H234a C234 H234e . . . 109.3 ?
C234 C235 C236 . . . 112.4(5) ?
C234 C235 H235a . . . 108.6 ?
C234 C235 H235e . . . 108.9 ?
C236 C235 H235a . . . 108.7 ?
C236 C235 H235e . . . 109.0 ?
H235a C235 H235e . . . 109.2 ?
C231 C236 C235 . . . 110.4(4) ?
C231 C236 H236a . . . 109.3 ?
C231 C236 H236e . . . 109.4 ?
C235 C236 H236a . . . 109.1 ?
C235 C236 H236e . . . 109.3 ?
H236a C236 H236e . . . 109.3 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ag O1 . . 2.448(6) ?
Ag O2 . . 2.532(4) ?
Ag P1 . . 2.4589(12) ?
Ag P2 . . 2.4609(12) ?
N O1 . . 1.223(6) ?
N O2 . . 1.215(9) ?
P1 C111 . . 1.849(5) ?
P1 C121 . . 1.861(5) ?
P1 C131 . . 1.858(4) ?
C111 C112 . . 1.528(5) ?
C111 C116 . . 1.541(7) ?
C111 H111 . . .953 ?
C112 C113 . . 1.523(8) ?
C112 H112a . . .953 ?
C112 H112e . . .952 ?
C113 C114 . . 1.525(10) ?
C113 H113a . . .953 ?
C113 H113e . . .952 ?
C114 C115 . . 1.513(6) ?
C114 H114a . . .952 ?
C114 H114e . . .950 ?
C115 C116 . . 1.522(8) ?
C115 H115a . . .951 ?
C115 H115e . . .951 ?
C116 H116a . . .952 ?
C116 H116e . . .952 ?
C121 C122 . . 1.529(7) ?
C121 C126 . . 1.510(7) ?
C121 H121 . . .953(3) ?
C122 C123 . . 1.515(8) ?
C122 H122a . . .954 ?
C122 H122e . . .951 ?
C123 C124 . . 1.504(8) ?
C123 H123a . . .951 ?
C123 H123e . . .951 ?
C124 C125 . . 1.509(9) ?
C124 H124a . . .950 ?
C124 H124e . . .950 ?
C125 C126 . . 1.535(8) ?
C125 H125a . . .952 ?
C125 H125e . . .951 ?
C126 H126a . . .953 ?
C126 H126e . . .951 ?
C131 C132 . . 1.528(6) ?
C131 C136 . . 1.521(6) ?
C131 H131 . . .952 ?
C132 C133 . . 1.512(6) ?
C132 H132a . . .952 ?
C132 H132e . . .953 ?
C133 C134 . . 1.516(8) ?
C133 H133a . . .951 ?
C133 H133e . . .950 ?
C134 C135 . . 1.505(8) ?
C134 H134a . . .952 ?
C134 H134e . . .952 ?
C135 C136 . . 1.526(6) ?
C135 H135a . . .950 ?
C135 H135e . . .953 ?
C136 H136a . . .952 ?
C136 H136e . . .949 ?
P2 C211 . . 1.844(5) ?
P2 C221 . . 1.853(3) ?
P2 C231 . . 1.852(5) ?
C211 C212 . . 1.520(7) ?
C211 C216A . . 1.380(12) ?
C211 C216B . . 1.433(17) ?
C211 H211A . . .952 ?
C211 H211B . . .953 ?
C212 C213A . . 1.55(2) ?
C212 C213B . . 1.51(2) ?
C212 H212Aa . . .948 ?
C212 H212Ae . . .957 ?
C212 H212Ba . . .957 ?
C212 H212Be . . .952 ?
C213A C214A . . 1.49(2) ?
C213A H213Aa . . .94 ?
C213A H213Ae . . .96 ?
C214A C215 . . 1.46(2) ?
C214A H214Aa . . .944 ?
C214A H214Ae . . .95 ?
C215 C216A . . 1.553(17) ?
C215 C214B . . 1.62(2) ?
C215 C216B . . 1.606(14) ?
C215 H215Aa . . .952 ?
C215 H215Ae . . .951 ?
C215 H215Ba . . .949 ?
C215 H215Be . . .952 ?
C216A H216Aa . . .967 ?
C216A H216Ae . . .945 ?
C213B C214B . . 1.47(3) ?
C213B H213Ba . . .952 ?
C213B H213Be . . .949 ?
C214B H214Ba . . .951 ?
C214B H214Be . . .96 ?
C216B H216Ba . . .946 ?
C216B H216Be . . .948 ?
C221 C222 . . 1.527(7) ?
C221 C226 . . 1.524(7) ?
C221 H221 . . .953 ?
C222 C223 . . 1.518(5) ?
C222 H222a . . .954 ?
C222 H222e . . .952 ?
C223 C224 . . 1.514(8) ?
C223 H223a . . .953 ?
C223 H223e . . .949 ?
C224 C225 . . 1.508(8) ?
C224 H224a . . .953 ?
C224 H224e . . .951 ?
C225 C226 . . 1.523(5) ?
C225 H225a . . .954 ?
C225 H225e . . .950 ?
C226 H226a . . .953 ?
C226 H226e . . .951 ?
C231 C232 . . 1.527(5) ?
C231 C236 . . 1.521(7) ?
C231 H231 . . .955 ?
C232 C233 . . 1.514(8) ?
C232 H232a . . .953 ?
C232 H232e . . .951 ?
C233 C234 . . 1.509(8) ?
C233 H233a . . .952 ?
C233 H233e . . .950 ?
C234 C235 . . 1.503(6) ?
C234 H234a . . .951 ?
C234 H234e . . .950 ?
C235 C236 . . 1.526(9) ?
C235 H235a . . .953 ?
C235 H235e . . .950 ?
C236 H236a . . .951 ?
C236 H236e . . .951 ?
